methyl 4-[2-[(4-fluorophenyl)sulfonyl-prop-2-enyl-amino]propanoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[2-[(4-fluorophenyl)sulfonyl-prop-2-enyl-amino]propanoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate Openeye Name: methyl 4-[2-[allyl-(4-fluorophenyl)sulfonyl-amino]propanoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate CAS Name: 4-[2-[(4-fluorophenyl)sulfonyl-prop-2-enylamino]-1-oxopropyl]-1,3,5-trimethyl-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-[(4-fluorophenyl)sulfonyl-prop-2-enylamino]propanoyl]-1,3,5-trimethylpyrrole-2-carboxylate Traditional Name: 4-[2-[allyl-(4-fluorophenyl)sulfonyl-amino]propanoyl]-1,3,5-trimethyl-pyrrole-2-carboxylic acid methyl ester Formula: C21H25FN2O5S MolecularWeight: 436.497003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C(=O)C(C)N(CC=C)S(=O)(=O)C2=CC=C(C=C2)F)C)C)C(=O)OC

Isomeric SMILES

CC1=C(N(C(=C1C(=O)C(C)N(CC=C)S(=O)(=O)C2=CC=C(C=C2)F)C)C)C(=O)OC

InChI

InChI=1S/C21H25FN2O5S/c1-7-12-24(30(27,28)17-10-8-16(22)9-11-17)15(4)20(25)18-13(2)19(21(26)29-6)23(5)14(18)3/h7-11,15H,1,12H2,2-6H3