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

Systemtic Name: N-(4-dimethylaminophenyl)-4-(furan-2-ylmethyl)-3-methyl-5-oxidanylidene-2H-1,4-benzothiazepine-3-carboxamide Openeye Name: N-(4-dimethylaminophenyl)-4-(2-furylmethyl)-3-methyl-5-oxo-2H-1,4-benzothiazepine-3-carboxamide CAS Name: N-(4-dimethylaminophenyl)-4-(2-furanylmethyl)-3-methyl-5-oxo-2H-1,4-benzothiazepine-3-carboxamide IUPAC Name: N-(4-dimethylaminophenyl)-4-(furan-2-ylmethyl)-3-methyl-5-oxo-2H-1,4-benzothiazepine-3-carboxamide Traditional Name: N-(4-dimethylaminophenyl)-4-(2-furfuryl)-5-keto-3-methyl-2H-1,4-benzothiazepine-3-carboxamide Formula: C24H25N3O3S MolecularWeight: 435.5386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H25N3O3S/c1-24(23(29)25-17-10-12-18(13-11-17)26(2)3)16-31-21-9-5-4-8-20(21)22(28)27(24)15-19-7-6-14-30-19/h4-14H,15-16H2,1-3H3,(H,25,29)