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

Systemtic Name: methyl 4-[2-[(4-tert-butylphenyl)sulfonyl-(oxolan-2-ylmethyl)amino]ethanoyl]-1-ethyl-3,5-dimethyl-pyrrole-2-carboxylate Openeye Name: methyl 4-[2-[(4-tert-butylphenyl)sulfonyl-(tetrahydrofuran-2-ylmethyl)amino]acetyl]-1-ethyl-3,5-dimethyl-pyrrole-2-carboxylate CAS Name: 4-[2-[(4-tert-butylphenyl)sulfonyl-(2-oxolanylmethyl)amino]-1-oxoethyl]-1-ethyl-3,5-dimethyl-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-[(4-tert-butylphenyl)sulfonyl-(oxolan-2-ylmethyl)amino]acetyl]-1-ethyl-3,5-dimethylpyrrole-2-carboxylate Traditional Name: 4-[2-[(4-tert-butylphenyl)sulfonyl-(tetrahydrofurfuryl)amino]acetyl]-1-ethyl-3,5-dimethyl-pyrrole-2-carboxylic acid methyl ester Formula: C27H38N2O6S MolecularWeight: 518.66542

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C1C(=O)OC)C)C(=O)CN(CC2CCCO2)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(CC2CCCO2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C)C

InChI

InChI=1S/C27H38N2O6S/c1-8-29-19(3)24(18(2)25(29)26(31)34-7)23(30)17-28(16-21-10-9-15-35-21)36(32,33)22-13-11-20(12-14-22)27(4,5)6/h11-14,21H,8-10,15-17H2,1-7H3