N-[(2-ethyl-1-benzofuran-3-yl)methyl]-N-methyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: N-[(2-ethyl-1-benzofuran-3-yl)methyl]-N-methyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-[(2-ethylbenzofuran-3-yl)methyl]-N-methyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-[(2-ethyl-3-benzofuranyl)methyl]-N-methyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-[(2-ethyl-1-benzofuran-3-yl)methyl]-N-methyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: N-[(2-ethylbenzofuran-3-yl)methyl]-4-keto-N-methyl-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2O1)CN(C)C(=O)C3=CC4=C(C=C3)SCCC(=O)N4

Isomeric SMILES

CCC1=C(C2=CC=CC=C2O1)CN(C)C(=O)C3=CC4=C(C=C3)SCCC(=O)N4

InChI

InChI=1S/C22H22N2O3S/c1-3-18-16(15-6-4-5-7-19(15)27-18)13-24(2)22(26)14-8-9-20-17(12-14)23-21(25)10-11-28-20/h4-9,12H,3,10-11,13H2,1-2H3,(H,23,25)