5-chloranyl-3-[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid

Systemtic Name: 5-chloranyl-3-[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid Openeye Name: 5-chloro-3-[2-(3-methylsulfanylanilino)-2-oxo-ethyl]-1H-indole-2-carboxylic acid CAS Name: 5-chloro-3-[2-[3-(methylthio)anilino]-2-oxoethyl]-1H-indole-2-carboxylic acid IUPAC Name: 5-chloro-3-[2-(3-methylsulfanylanilino)-2-oxoethyl]-1H-indole-2-carboxylic acid Traditional Name: 5-chloro-3-[2-keto-2-[3-(methylthio)anilino]ethyl]-1H-indole-2-carboxylic acid Formula: C18H15ClN2O3S MolecularWeight: 374.8413

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)CC2=C(NC3=C2C=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)CC2=C(NC3=C2C=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C18H15ClN2O3S/c1-25-12-4-2-3-11(8-12)20-16(22)9-14-13-7-10(19)5-6-15(13)21-17(14)18(23)24/h2-8,21H,9H2,1H3,(H,20,22)(H,23,24)