N-hexyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: N-hexyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-hexyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-hexyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-hexyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: N-hexyl-4-keto-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C16H22N2O2S MolecularWeight: 306.42308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=CC2=C(C=C1)SCCC(=O)N2

Isomeric SMILES

CCCCCCNC(=O)C1=CC2=C(C=C1)SCCC(=O)N2

InChI

InChI=1S/C16H22N2O2S/c1-2-3-4-5-9-17-16(20)12-6-7-14-13(11-12)18-15(19)8-10-21-14/h6-7,11H,2-5,8-10H2,1H3,(H,17,20)(H,18,19)