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

Systemtic Name: methyl 3,5-dimethyl-4-[2-[phenylsulfonyl(prop-2-enyl)amino]ethanoyl]-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-[2-[allyl(benzenesulfonyl)amino]acetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[2-[benzenesulfonyl(prop-2-enyl)amino]-1-oxoethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-[2-[benzenesulfonyl(prop-2-enyl)amino]acetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[2-[allyl(besyl)amino]acetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid methyl ester Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)CN(CC=C)S(=O)(=O)C2=CC=CC=C2)C)C(=O)OC

Isomeric SMILES

CC1=C(NC(=C1C(=O)CN(CC=C)S(=O)(=O)C2=CC=CC=C2)C)C(=O)OC

InChI

InChI=1S/C19H22N2O5S/c1-5-11-21(27(24,25)15-9-7-6-8-10-15)12-16(22)17-13(2)18(19(23)26-4)20-14(17)3/h5-10,20H,1,11-12H2,2-4H3