2-[3-(4-chlorophenyl)sulfanyl-2-methyl-4-phenyl-indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-(4-chlorophenyl)sulfanyl-2-methyl-4-phenyl-indol-1-yl]ethanoic acid Openeye Name: 2-[3-(4-chlorophenyl)sulfanyl-2-methyl-4-phenyl-indol-1-yl]acetic acid CAS Name: 2-[3-[(4-chlorophenyl)thio]-2-methyl-4-phenyl-1-indolyl]acetic acid IUPAC Name: 2-[3-(4-chlorophenyl)sulfanyl-2-methyl-4-phenylindol-1-yl]acetic acid Traditional Name: 2-[3-[(4-chlorophenyl)thio]-2-methyl-4-phenyl-indol-1-yl]acetic acid Formula: C23H18ClNO2S MolecularWeight: 407.91252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=CC=C2N1CC(=O)O)C3=CC=CC=C3)SC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C2=C(C=CC=C2N1CC(=O)O)C3=CC=CC=C3)SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H18ClNO2S/c1-15-23(28-18-12-10-17(24)11-13-18)22-19(16-6-3-2-4-7-16)8-5-9-20(22)25(15)14-21(26)27/h2-13H,14H2,1H3,(H,26,27)