methyl 1-ethyl-3,5-dimethyl-4-[2-[3-methylbutyl-[(E)-2-phenylethenyl]sulfonyl-amino]ethanoyl]pyrrole-2-carboxylate

Systemtic Name: methyl 1-ethyl-3,5-dimethyl-4-[2-[3-methylbutyl-[(E)-2-phenylethenyl]sulfonyl-amino]ethanoyl]pyrrole-2-carboxylate Openeye Name: methyl 1-ethyl-4-[2-[isopentyl-[(E)-styryl]sulfonyl-amino]acetyl]-3,5-dimethyl-pyrrole-2-carboxylate CAS Name: 1-ethyl-3,5-dimethyl-4-[2-[3-methylbutyl-[(E)-2-phenylethenyl]sulfonylamino]-1-oxoethyl]-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-ethyl-3,5-dimethyl-4-[2-[3-methylbutyl-[(E)-2-phenylethenyl]sulfonylamino]acetyl]pyrrole-2-carboxylate Traditional Name: 1-ethyl-4-[2-[isoamyl-[(E)-styryl]sulfonyl-amino]acetyl]-3,5-dimethyl-pyrrole-2-carboxylic acid methyl ester Formula: C25H34N2O5S MolecularWeight: 474.61286

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C1C(=O)OC)C)C(=O)CN(CCC(C)C)S(=O)(=O)C=CC2=CC=CC=C2)C

Isomeric SMILES

CCN1C(=C(C(=C1C(=O)OC)C)C(=O)CN(CCC(C)C)S(=O)(=O)/C=C/C2=CC=CC=C2)C

InChI

InChI=1S/C25H34N2O5S/c1-7-27-20(5)23(19(4)24(27)25(29)32-6)22(28)17-26(15-13-18(2)3)33(30,31)16-14-21-11-9-8-10-12-21/h8-12,14,16,18H,7,13,15,17H2,1-6H3/b16-14+