2-(4-methoxyphenyl)-8-methyl-4-thiophen-2-yl-2,5-dihydro-1,5-benzothiazepine

Systemtic Name: 2-(4-methoxyphenyl)-8-methyl-4-thiophen-2-yl-2,5-dihydro-1,5-benzothiazepine Openeye Name: 2-(4-methoxyphenyl)-8-methyl-4-(2-thienyl)-2,5-dihydro-1,5-benzothiazepine CAS Name: 2-(4-methoxyphenyl)-8-methyl-4-thiophen-2-yl-2,5-dihydro-1,5-benzothiazepine IUPAC Name: 2-(4-methoxyphenyl)-8-methyl-4-thiophen-2-yl-2,5-dihydro-1,5-benzothiazepine Traditional Name: 2-(4-methoxyphenyl)-8-methyl-4-(2-thienyl)-2,5-dihydro-1,5-benzothiazepine Formula: C21H19NOS2 MolecularWeight: 365.51166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=CC(S2)C3=CC=C(C=C3)OC)C4=CC=CS4

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=CC(S2)C3=CC=C(C=C3)OC)C4=CC=CS4

InChI

InChI=1S/C21H19NOS2/c1-14-5-10-17-21(12-14)25-20(15-6-8-16(23-2)9-7-15)13-18(22-17)19-4-3-11-24-19/h3-13,20,22H,1-2H3