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

Systemtic Name: 4-oxidanylidene-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-[[4-(benzyloxymethyl)phenyl]methyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: 4-oxo-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: 4-oxo-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: N-[4-(benzoxymethyl)benzyl]-4-keto-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C25H24N2O3S MolecularWeight: 432.53466

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)COCC4=CC=CC=C4)NC1=O

Isomeric SMILES

C1CSC2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)COCC4=CC=CC=C4)NC1=O

InChI

InChI=1S/C25H24N2O3S/c28-24-12-13-31-23-11-10-21(14-22(23)27-24)25(29)26-15-18-6-8-20(9-7-18)17-30-16-19-4-2-1-3-5-19/h1-11,14H,12-13,15-17H2,(H,26,29)(H,27,28)