[2-[(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)amino]-2-oxidanylidene-ethyl] 2-(phenylsulfonylamino)ethanoate

Systemtic Name: [2-[(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)amino]-2-oxidanylidene-ethyl] 2-(phenylsulfonylamino)ethanoate Openeye Name: [2-[(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)amino]-2-oxo-ethyl] 2-(benzenesulfonamido)acetate CAS Name: 2-(benzenesulfonamido)acetic acid [2-[(3-cyano-1-cyclohexyl-4,5-dimethyl-2-pyrrolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(3-cyano-1-cyclohexyl-4,5-dimethylpyrrol-2-yl)amino]-2-oxoethyl] 2-(benzenesulfonamido)acetate Traditional Name: 2-(benzenesulfonamido)acetic acid [2-[(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)amino]-2-keto-ethyl] ester Formula: C23H28N4O5S MolecularWeight: 472.55722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)COC(=O)CNS(=O)(=O)C2=CC=CC=C2)C3CCCCC3)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)COC(=O)CNS(=O)(=O)C2=CC=CC=C2)C3CCCCC3)C

InChI

InChI=1S/C23H28N4O5S/c1-16-17(2)27(18-9-5-3-6-10-18)23(20(16)13-24)26-21(28)15-32-22(29)14-25-33(30,31)19-11-7-4-8-12-19/h4,7-8,11-12,18,25H,3,5-6,9-10,14-15H2,1-2H3,(H,26,28)