N-cyclopentyl-6-oxidanylidene-N-(thiophen-2-ylmethyl)-5H-benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: N-cyclopentyl-6-oxidanylidene-N-(thiophen-2-ylmethyl)-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: N-cyclopentyl-6-oxo-N-(2-thienylmethyl)-5H-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: N-cyclopentyl-6-oxo-N-(thiophen-2-ylmethyl)-5H-benzo[b][1,4]benzothiazepine-3-carboxamide IUPAC Name: N-cyclopentyl-6-oxo-N-(thiophen-2-ylmethyl)-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: N-cyclopentyl-6-keto-N-(2-thenyl)-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C24H22N2O2S2 MolecularWeight: 434.57368

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(CC2=CC=CS2)C(=O)C3=CC4=C(C=C3)SC5=CC=CC=C5C(=O)N4

Isomeric SMILES

C1CCC(C1)N(CC2=CC=CS2)C(=O)C3=CC4=C(C=C3)SC5=CC=CC=C5C(=O)N4

InChI

InChI=1S/C24H22N2O2S2/c27-23-19-9-3-4-10-21(19)30-22-12-11-16(14-20(22)25-23)24(28)26(17-6-1-2-7-17)15-18-8-5-13-29-18/h3-5,8-14,17H,1-2,6-7,15H2,(H,25,27)