2-[2-[(4-cyclohexylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-[(4-cyclohexylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoic acid Openeye Name: 2-[2-(4-cyclohexylanilino)-2-oxo-ethyl]sulfanylacetic acid CAS Name: 2-[[2-(4-cyclohexylanilino)-2-oxoethyl]thio]acetic acid IUPAC Name: 2-[2-(4-cyclohexylanilino)-2-oxoethyl]sulfanylacetic acid Traditional Name: 2-[[2-(4-cyclohexylanilino)-2-keto-ethyl]thio]acetic acid Formula: C16H21NO3S MolecularWeight: 307.40784

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)NC(=O)CSCC(=O)O

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)NC(=O)CSCC(=O)O

InChI

InChI=1S/C16H21NO3S/c18-15(10-21-11-16(19)20)17-14-8-6-13(7-9-14)12-4-2-1-3-5-12/h6-9,12H,1-5,10-11H2,(H,17,18)(H,19,20)