N-(2,4-dimethoxyphenyl)-4-(furan-2-ylmethyl)-3-methyl-5-oxidanylidene-2H-1,4-benzothiazepine-3-carboxamide

Systemtic Name: N-(2,4-dimethoxyphenyl)-4-(furan-2-ylmethyl)-3-methyl-5-oxidanylidene-2H-1,4-benzothiazepine-3-carboxamide Openeye Name: N-(2,4-dimethoxyphenyl)-4-(2-furylmethyl)-3-methyl-5-oxo-2H-1,4-benzothiazepine-3-carboxamide CAS Name: N-(2,4-dimethoxyphenyl)-4-(2-furanylmethyl)-3-methyl-5-oxo-2H-1,4-benzothiazepine-3-carboxamide IUPAC Name: N-(2,4-dimethoxyphenyl)-4-(furan-2-ylmethyl)-3-methyl-5-oxo-2H-1,4-benzothiazepine-3-carboxamide Traditional Name: N-(2,4-dimethoxyphenyl)-4-(2-furfuryl)-5-keto-3-methyl-2H-1,4-benzothiazepine-3-carboxamide Formula: C24H24N2O5S MolecularWeight: 452.52276

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CSC2=CC=CC=C2C(=O)N1CC3=CC=CO3)C(=O)NC4=C(C=C(C=C4)OC)OC

Isomeric SMILES

CC1(CSC2=CC=CC=C2C(=O)N1CC3=CC=CO3)C(=O)NC4=C(C=C(C=C4)OC)OC

InChI

InChI=1S/C24H24N2O5S/c1-24(23(28)25-19-11-10-16(29-2)13-20(19)30-3)15-32-21-9-5-4-8-18(21)22(27)26(24)14-17-7-6-12-31-17/h4-13H,14-15H2,1-3H3,(H,25,28)