methyl 4-[2-[cyclohexylmethyl(phenylsulfonyl)amino]ethanoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[2-[cyclohexylmethyl(phenylsulfonyl)amino]ethanoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-[2-[benzenesulfonyl(cyclohexylmethyl)amino]acetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[2-[benzenesulfonyl(cyclohexylmethyl)amino]-1-oxoethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-[2-[benzenesulfonyl(cyclohexylmethyl)amino]acetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[2-[besyl(cyclohexylmethyl)amino]acetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid methyl ester Formula: C23H30N2O5S MolecularWeight: 446.5597

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)CN(CC2CCCCC2)S(=O)(=O)C3=CC=CC=C3)C)C(=O)OC

Isomeric SMILES

CC1=C(NC(=C1C(=O)CN(CC2CCCCC2)S(=O)(=O)C3=CC=CC=C3)C)C(=O)OC

InChI

InChI=1S/C23H30N2O5S/c1-16-21(17(2)24-22(16)23(27)30-3)20(26)15-25(14-18-10-6-4-7-11-18)31(28,29)19-12-8-5-9-13-19/h5,8-9,12-13,18,24H,4,6-7,10-11,14-15H2,1-3H3