2-(2-methoxyphenyl)-5-(thiophen-2-ylmethyl)-3,4-dihydro-2H-1,5-benzothiazepine

Systemtic Name: 2-(2-methoxyphenyl)-5-(thiophen-2-ylmethyl)-3,4-dihydro-2H-1,5-benzothiazepine Openeye Name: 2-(2-methoxyphenyl)-5-(2-thienylmethyl)-3,4-dihydro-2H-1,5-benzothiazepine CAS Name: 2-(2-methoxyphenyl)-5-(thiophen-2-ylmethyl)-3,4-dihydro-2H-1,5-benzothiazepine IUPAC Name: 2-(2-methoxyphenyl)-5-(thiophen-2-ylmethyl)-3,4-dihydro-2H-1,5-benzothiazepine Traditional Name: 2-(2-methoxyphenyl)-5-(2-thenyl)-3,4-dihydro-2H-1,5-benzothiazepine Formula: C21H21NOS2 MolecularWeight: 367.52754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2CCN(C3=CC=CC=C3S2)CC4=CC=CS4

Isomeric SMILES

COC1=CC=CC=C1C2CCN(C3=CC=CC=C3S2)CC4=CC=CS4

InChI

InChI=1S/C21H21NOS2/c1-23-19-10-4-2-8-17(19)20-12-13-22(15-16-7-6-14-24-16)18-9-3-5-11-21(18)25-20/h2-11,14,20H,12-13,15H2,1H3