Abstract
The title heterocyclic compound, C17H23N3O2S, was synthesized from 4-(4-methylcyclohex-3-enyl)pent-3-en-2-one, which was isolated from Cedrus atlantica essential oil. The thiadiazole ring adopts a flattened envelope conformation, with the flap sp 3-hybridized C atom lying 0.259 (1) Å out of the plane of the other four atoms. The screw-related molecules are linked into chains along the b axis by intermolecular N—H⋯O hydrogen bonds.
Highlights
Structure Reports OnlineMaya,b Bouhmaida Nouzha,c Ahmed Benharrefd and Moha Berrahoa*
The title heterocyclic compound, C17H23N3O2S, was synthesized from 4-(4-methylcyclohex-3-enyl)pent-3-en-2-one, which was isolated from Cedrus atlantica essential oil
The screw-related molecules are linked into chains along the b axis by intermolecular N— HÁ Á ÁO hydrogen bonds
Summary
Maya,b Bouhmaida Nouzha,c Ahmed Benharrefd and Moha Berrahoa*. Key indicators: single-crystal X-ray study; T = 298 K; mean (C–C) = 0.001 A; R factor = 0.035; wR factor = 0.108; data-to-parameter ratio = 37.5. The title heterocyclic compound, C17H23N3O2S, was synthesized from 4-(4-methylcyclohex-3-enyl)pent-3-en-2-one, which was isolated from Cedrus atlantica essential oil. The thiadiazole ring adopts a flattened envelope conformation, with the flap sp3-hybridized C atom lying 0.259 (1) Aout of the plane of the other four atoms. The screw-related molecules are linked into chains along the b axis by intermolecular N— HÁ Á ÁO hydrogen bonds
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