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

Systemtic Name: N-[3-[methyl(phenyl)amino]propyl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-[3-(N-methylanilino)propyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-[3-(N-methylanilino)propyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-[3-(N-methylanilino)propyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: 4-keto-N-[3-(N-methylanilino)propyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1=CC2=C(C=C1)SCCC(=O)N2)C3=CC=CC=C3

Isomeric SMILES

CN(CCCNC(=O)C1=CC2=C(C=C1)SCCC(=O)N2)C3=CC=CC=C3

InChI

InChI=1S/C20H23N3O2S/c1-23(16-6-3-2-4-7-16)12-5-11-21-20(25)15-8-9-18-17(14-15)22-19(24)10-13-26-18/h2-4,6-9,14H,5,10-13H2,1H3,(H,21,25)(H,22,24)