2-(3,4-dimethoxyphenyl)-8-ethoxy-4-thiophen-2-yl-2,5-dihydro-1,5-benzothiazepine

Systemtic Name: 2-(3,4-dimethoxyphenyl)-8-ethoxy-4-thiophen-2-yl-2,5-dihydro-1,5-benzothiazepine Openeye Name: 2-(3,4-dimethoxyphenyl)-8-ethoxy-4-(2-thienyl)-2,5-dihydro-1,5-benzothiazepine CAS Name: 2-(3,4-dimethoxyphenyl)-8-ethoxy-4-thiophen-2-yl-2,5-dihydro-1,5-benzothiazepine IUPAC Name: 2-(3,4-dimethoxyphenyl)-8-ethoxy-4-thiophen-2-yl-2,5-dihydro-1,5-benzothiazepine Traditional Name: 2-(3,4-dimethoxyphenyl)-8-ethoxy-4-(2-thienyl)-2,5-dihydro-1,5-benzothiazepine Formula: C23H23NO3S2 MolecularWeight: 425.56362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=CC(S2)C3=CC(=C(C=C3)OC)OC)C4=CC=CS4

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=CC(S2)C3=CC(=C(C=C3)OC)OC)C4=CC=CS4

InChI

InChI=1S/C23H23NO3S2/c1-4-27-16-8-9-17-23(13-16)29-22(14-18(24-17)21-6-5-11-28-21)15-7-10-19(25-2)20(12-15)26-3/h5-14,22,24H,4H2,1-3H3