2-[5-chloranyl-3-(4-chlorophenyl)sulfanyl-6-cyano-2-methyl-indol-1-yl]ethanoic acid

Systemtic Name: 2-[5-chloranyl-3-(4-chlorophenyl)sulfanyl-6-cyano-2-methyl-indol-1-yl]ethanoic acid Openeye Name: 2-[5-chloro-3-(4-chlorophenyl)sulfanyl-6-cyano-2-methyl-indol-1-yl]acetic acid CAS Name: 2-[5-chloro-3-[(4-chlorophenyl)thio]-6-cyano-2-methyl-1-indolyl]acetic acid IUPAC Name: 2-[5-chloro-3-(4-chlorophenyl)sulfanyl-6-cyano-2-methylindol-1-yl]acetic acid Traditional Name: 2-[5-chloro-3-[(4-chlorophenyl)thio]-6-cyano-2-methyl-indol-1-yl]acetic acid Formula: C18H12Cl2N2O2S MolecularWeight: 391.27108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC(=O)O)C=C(C(=C2)Cl)C#N)SC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C2=C(N1CC(=O)O)C=C(C(=C2)Cl)C#N)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H12Cl2N2O2S/c1-10-18(25-13-4-2-12(19)3-5-13)14-7-15(20)11(8-21)6-16(14)22(10)9-17(23)24/h2-7H,9H2,1H3,(H,23,24)