methyl 4-[2-[5-chloranyl-1-(diphenylmethyl)-2-methyl-indol-3-yl]ethylsulfanyl]benzoate

Systemtic Name: methyl 4-[2-[5-chloranyl-1-(diphenylmethyl)-2-methyl-indol-3-yl]ethylsulfanyl]benzoate Openeye Name: methyl 4-[2-(1-benzhydryl-5-chloro-2-methyl-indol-3-yl)ethylsulfanyl]benzoate CAS Name: 4-[2-[5-chloro-1-(diphenylmethyl)-2-methyl-3-indolyl]ethylthio]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(1-benzhydryl-5-chloro-2-methylindol-3-yl)ethylsulfanyl]benzoate Traditional Name: 4-[2-(1-benzhydryl-5-chloro-2-methyl-indol-3-yl)ethylthio]benzoic acid methyl ester Formula: C32H28ClNO2S MolecularWeight: 526.08822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C(C3=CC=CC=C3)C4=CC=CC=C4)C=CC(=C2)Cl)CCSC5=CC=C(C=C5)C(=O)OC

Isomeric SMILES

CC1=C(C2=C(N1C(C3=CC=CC=C3)C4=CC=CC=C4)C=CC(=C2)Cl)CCSC5=CC=C(C=C5)C(=O)OC

InChI

InChI=1S/C32H28ClNO2S/c1-22-28(19-20-37-27-16-13-25(14-17-27)32(35)36-2)29-21-26(33)15-18-30(29)34(22)31(23-9-5-3-6-10-23)24-11-7-4-8-12-24/h3-18,21,31H,19-20H2,1-2H3