(2-oxidanylidene-2-phenylazanyl-ethyl) 2-[2-[cyclohexyl(methyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 2-[2-[cyclohexyl(methyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: (2-anilino-2-oxo-ethyl) 2-[2-[cyclohexyl(methyl)amino]-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-[cyclohexyl(methyl)amino]-2-oxoethyl]thio]benzoic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 2-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-[cyclohexyl(methyl)amino]-2-keto-ethyl]thio]benzoic acid (2-anilino-2-keto-ethyl) ester Formula: C24H28N2O4S MolecularWeight: 440.55512

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)CSC2=CC=CC=C2C(=O)OCC(=O)NC3=CC=CC=C3

Isomeric SMILES

CN(C1CCCCC1)C(=O)CSC2=CC=CC=C2C(=O)OCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C24H28N2O4S/c1-26(19-12-6-3-7-13-19)23(28)17-31-21-15-9-8-14-20(21)24(29)30-16-22(27)25-18-10-4-2-5-11-18/h2,4-5,8-11,14-15,19H,3,6-7,12-13,16-17H2,1H3,(H,25,27)