4-[4-(2,4-dichlorophenyl)-9-methoxy-2,3-dihydro-1,5-benzothiazepin-2-yl]-2-methoxy-phenol

Systemtic Name: 4-[4-(2,4-dichlorophenyl)-9-methoxy-2,3-dihydro-1,5-benzothiazepin-2-yl]-2-methoxy-phenol Openeye Name: 4-[4-(2,4-dichlorophenyl)-9-methoxy-2,3-dihydro-1,5-benzothiazepin-2-yl]-2-methoxy-phenol CAS Name: 4-[4-(2,4-dichlorophenyl)-9-methoxy-2,3-dihydro-1,5-benzothiazepin-2-yl]-2-methoxyphenol IUPAC Name: 4-[4-(2,4-dichlorophenyl)-9-methoxy-2,3-dihydro-1,5-benzothiazepin-2-yl]-2-methoxyphenol Traditional Name: 4-[4-(2,4-dichlorophenyl)-9-methoxy-2,3-dihydro-1,5-benzothiazepin-2-yl]-2-methoxy-phenol Formula: C23H19Cl2NO3S MolecularWeight: 460.37286

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1SC(CC(=N2)C3=C(C=C(C=C3)Cl)Cl)C4=CC(=C(C=C4)O)OC

Isomeric SMILES

COC1=CC=CC2=C1SC(CC(=N2)C3=C(C=C(C=C3)Cl)Cl)C4=CC(=C(C=C4)O)OC

InChI

InChI=1S/C23H19Cl2NO3S/c1-28-20-5-3-4-17-23(20)30-22(13-6-9-19(27)21(10-13)29-2)12-18(26-17)15-8-7-14(24)11-16(15)25/h3-11,22,27H,12H2,1-2H3