[2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl] 2-[(5-methylthiophen-2-yl)carbonylamino]ethanoate

Systemtic Name: [2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl] 2-[(5-methylthiophen-2-yl)carbonylamino]ethanoate Openeye Name: [2-(4-cyclohexylphenyl)-2-oxo-ethyl] 2-[(5-methylthiophene-2-carbonyl)amino]acetate CAS Name: 2-[[(5-methyl-2-thiophenyl)-oxomethyl]amino]acetic acid [2-(4-cyclohexylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-cyclohexylphenyl)-2-oxoethyl] 2-[(5-methylthiophene-2-carbonyl)amino]acetate Traditional Name: 2-[(5-methylthiophene-2-carbonyl)amino]acetic acid [2-(4-cyclohexylphenyl)-2-keto-ethyl] ester Formula: C22H25NO4S MolecularWeight: 399.5032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)NCC(=O)OCC(=O)C2=CC=C(C=C2)C3CCCCC3

Isomeric SMILES

CC1=CC=C(S1)C(=O)NCC(=O)OCC(=O)C2=CC=C(C=C2)C3CCCCC3

InChI

InChI=1S/C22H25NO4S/c1-15-7-12-20(28-15)22(26)23-13-21(25)27-14-19(24)18-10-8-17(9-11-18)16-5-3-2-4-6-16/h7-12,16H,2-6,13-14H2,1H3,(H,23,26)