N-(1,3-benzothiazol-2-ylmethyl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-4-keto-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C18H15N3O2S2 MolecularWeight: 369.4606

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C=C(C=C2)C(=O)NCC3=NC4=CC=CC=C4S3)NC1=O

Isomeric SMILES

C1CSC2=C(C=C(C=C2)C(=O)NCC3=NC4=CC=CC=C4S3)NC1=O

InChI

InChI=1S/C18H15N3O2S2/c22-16-7-8-24-14-6-5-11(9-13(14)20-16)18(23)19-10-17-21-12-3-1-2-4-15(12)25-17/h1-6,9H,7-8,10H2,(H,19,23)(H,20,22)