4-oxidanylidene-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: 4-oxidanylidene-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: 4-oxo-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: 4-oxo-N-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: 4-oxo-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: 4-keto-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)C4=CC5=C(C=C4)SCCC(=O)N5

Isomeric SMILES

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)C4=CC5=C(C=C4)SCCC(=O)N5

InChI

InChI=1S/C21H20N2O4S/c24-19-7-10-28-18-6-3-13(11-15(18)23-19)20(25)22-14-4-5-16-17(12-14)27-21(26-16)8-1-2-9-21/h3-6,11-12H,1-2,7-10H2,(H,22,25)(H,23,24)