N-(furan-2-ylmethyl)-N-[[4-(methylcarbamoyl)phenyl]methyl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: N-(furan-2-ylmethyl)-N-[[4-(methylcarbamoyl)phenyl]methyl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-(2-furylmethyl)-N-[[4-(methylcarbamoyl)phenyl]methyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-(2-furanylmethyl)-N-[[4-(methylcarbamoyl)phenyl]methyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-(furan-2-ylmethyl)-N-[[4-(methylcarbamoyl)phenyl]methyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: N-(2-furfuryl)-4-keto-N-[4-(methylcarbamoyl)benzyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C24H23N3O4S MolecularWeight: 449.52212

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)CN(CC2=CC=CO2)C(=O)C3=CC4=C(C=C3)SCCC(=O)N4

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)CN(CC2=CC=CO2)C(=O)C3=CC4=C(C=C3)SCCC(=O)N4

InChI

InChI=1S/C24H23N3O4S/c1-25-23(29)17-6-4-16(5-7-17)14-27(15-19-3-2-11-31-19)24(30)18-8-9-21-20(13-18)26-22(28)10-12-32-21/h2-9,11,13H,10,12,14-15H2,1H3,(H,25,29)(H,26,28)