methyl 4-[2-[(4-tert-butylphenyl)sulfonyl-cyclohexyl-amino]ethanoyl]-1-ethyl-3,5-dimethyl-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[2-[(4-tert-butylphenyl)sulfonyl-cyclohexyl-amino]ethanoyl]-1-ethyl-3,5-dimethyl-pyrrole-2-carboxylate Openeye Name: methyl 4-[2-[(4-tert-butylphenyl)sulfonyl-cyclohexyl-amino]acetyl]-1-ethyl-3,5-dimethyl-pyrrole-2-carboxylate CAS Name: 4-[2-[(4-tert-butylphenyl)sulfonyl-cyclohexylamino]-1-oxoethyl]-1-ethyl-3,5-dimethyl-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-[(4-tert-butylphenyl)sulfonyl-cyclohexylamino]acetyl]-1-ethyl-3,5-dimethylpyrrole-2-carboxylate Traditional Name: 4-[2-[(4-tert-butylphenyl)sulfonyl-cyclohexyl-amino]acetyl]-1-ethyl-3,5-dimethyl-pyrrole-2-carboxylic acid methyl ester Formula: C28H40N2O5S MolecularWeight: 516.6926

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C1C(=O)OC)C)C(=O)CN(C2CCCCC2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C)C

Isomeric SMILES

CCN1C(=C(C(=C1C(=O)OC)C)C(=O)CN(C2CCCCC2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C)C

InChI

InChI=1S/C28H40N2O5S/c1-8-29-20(3)25(19(2)26(29)27(32)35-7)24(31)18-30(22-12-10-9-11-13-22)36(33,34)23-16-14-21(15-17-23)28(4,5)6/h14-17,22H,8-13,18H2,1-7H3