5-chloranyl-3-(4-propan-2-ylphenyl)sulfanyl-1H-indole-2-carboxylic acid

Systemtic Name: 5-chloranyl-3-(4-propan-2-ylphenyl)sulfanyl-1H-indole-2-carboxylic acid Openeye Name: 5-chloro-3-(4-isopropylphenyl)sulfanyl-1H-indole-2-carboxylic acid CAS Name: 5-chloro-3-[(4-propan-2-ylphenyl)thio]-1H-indole-2-carboxylic acid IUPAC Name: 5-chloro-3-(4-propan-2-ylphenyl)sulfanyl-1H-indole-2-carboxylic acid Traditional Name: 5-chloro-3-(p-cumenylthio)-1H-indole-2-carboxylic acid Formula: C18H16ClNO2S MolecularWeight: 345.84314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)SC2=C(NC3=C2C=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)SC2=C(NC3=C2C=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C18H16ClNO2S/c1-10(2)11-3-6-13(7-4-11)23-17-14-9-12(19)5-8-15(14)20-16(17)18(21)22/h3-10,20H,1-2H3,(H,21,22)