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

Systemtic Name: methyl 4-[2-[cyclohexylmethyl-(4-fluorophenyl)sulfonyl-amino]ethanoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-[2-[cyclohexylmethyl-(4-fluorophenyl)sulfonyl-amino]acetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[2-[cyclohexylmethyl-(4-fluorophenyl)sulfonylamino]-1-oxoethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-[2-[cyclohexylmethyl-(4-fluorophenyl)sulfonylamino]acetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[2-[cyclohexylmethyl-(4-fluorophenyl)sulfonyl-amino]acetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid methyl ester Formula: C23H29FN2O5S MolecularWeight: 464.550163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29FN2O5S/c1-15-21(16(2)25-22(15)23(28)31-3)20(27)14-26(13-17-7-5-4-6-8-17)32(29,30)19-11-9-18(24)10-12-19/h9-12,17,25H,4-8,13-14H2,1-3H3