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

Systemtic Name: 4-[4-(2,4-dichlorophenyl)-9-methyl-2,3-dihydro-1,5-benzothiazepin-2-yl]-2-methoxy-phenol Openeye Name: 4-[4-(2,4-dichlorophenyl)-9-methyl-2,3-dihydro-1,5-benzothiazepin-2-yl]-2-methoxy-phenol CAS Name: 4-[4-(2,4-dichlorophenyl)-9-methyl-2,3-dihydro-1,5-benzothiazepin-2-yl]-2-methoxyphenol IUPAC Name: 4-[4-(2,4-dichlorophenyl)-9-methyl-2,3-dihydro-1,5-benzothiazepin-2-yl]-2-methoxyphenol Traditional Name: 4-[4-(2,4-dichlorophenyl)-9-methyl-2,3-dihydro-1,5-benzothiazepin-2-yl]-2-methoxy-phenol Formula: C23H19Cl2NO2S MolecularWeight: 444.37346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(CC(S2)C3=CC(=C(C=C3)O)OC)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(CC(S2)C3=CC(=C(C=C3)O)OC)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C23H19Cl2NO2S/c1-13-4-3-5-18-23(13)29-22(14-6-9-20(27)21(10-14)28-2)12-19(26-18)16-8-7-15(24)11-17(16)25/h3-11,22,27H,12H2,1-2H3