1-butyl-8-chloranyl-2,5-bis(oxidanylidene)-N-(1,3-thiazol-2-yl)-3,4-dihydro-1-benzazepine-4-carboxamide

Systemtic Name: 1-butyl-8-chloranyl-2,5-bis(oxidanylidene)-N-(1,3-thiazol-2-yl)-3,4-dihydro-1-benzazepine-4-carboxamide Openeye Name: 1-butyl-8-chloro-2,5-dioxo-N-thiazol-2-yl-3,4-dihydro-1-benzazepine-4-carboxamide CAS Name: 1-butyl-8-chloro-2,5-dioxo-N-(2-thiazolyl)-3,4-dihydro-1-benzazepine-4-carboxamide IUPAC Name: 1-butyl-8-chloro-2,5-dioxo-N-(1,3-thiazol-2-yl)-3,4-dihydro-1-benzazepine-4-carboxamide Traditional Name: 1-butyl-8-chloro-2,5-diketo-N-thiazol-2-yl-3,4-dihydro-1-benzazepine-4-carboxamide Formula: C18H18ClN3O3S MolecularWeight: 391.87182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)CC(C(=O)C2=C1C=C(C=C2)Cl)C(=O)NC3=NC=CS3

Isomeric SMILES

CCCCN1C(=O)CC(C(=O)C2=C1C=C(C=C2)Cl)C(=O)NC3=NC=CS3

InChI

InChI=1S/C18H18ClN3O3S/c1-2-3-7-22-14-9-11(19)4-5-12(14)16(24)13(10-15(22)23)17(25)21-18-20-6-8-26-18/h4-6,8-9,13H,2-3,7,10H2,1H3,(H,20,21,25)