2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanoylamino]thiophene-3-carboxamide Openeye Name: 2-[[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-1-oxoethyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetyl]amino]thiophene-3-carboxamide Formula: C16H17N3O2S2 MolecularWeight: 347.45508

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)CC(=O)NC3=C(C=CS3)C(=O)N

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)CC(=O)NC3=C(C=CS3)C(=O)N

InChI

InChI=1S/C16H17N3O2S2/c17-15(21)11-6-9-23-16(11)18-14(20)10-19-7-3-8-22-13-5-2-1-4-12(13)19/h1-2,4-6,9H,3,7-8,10H2,(H2,17,21)(H,18,20)