2-[(4-fluorophenyl)sulfonyl-prop-2-enyl-amino]-N-(2-methylpropyl)-N-[(1-methylpyrrol-2-yl)methyl]ethanamide

Systemtic Name: 2-[(4-fluorophenyl)sulfonyl-prop-2-enyl-amino]-N-(2-methylpropyl)-N-[(1-methylpyrrol-2-yl)methyl]ethanamide Openeye Name: 2-[allyl-(4-fluorophenyl)sulfonyl-amino]-N-isobutyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide CAS Name: 2-[(4-fluorophenyl)sulfonyl-prop-2-enylamino]-N-(2-methylpropyl)-N-[(1-methyl-2-pyrrolyl)methyl]acetamide IUPAC Name: 2-[(4-fluorophenyl)sulfonyl-prop-2-enylamino]-N-(2-methylpropyl)-N-[(1-methylpyrrol-2-yl)methyl]acetamide Traditional Name: 2-[allyl-(4-fluorophenyl)sulfonyl-amino]-N-isobutyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide Formula: C21H28FN3O3S MolecularWeight: 421.528723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC=CN1C)C(=O)CN(CC=C)S(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)CN(CC1=CC=CN1C)C(=O)CN(CC=C)S(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C21H28FN3O3S/c1-5-12-25(29(27,28)20-10-8-18(22)9-11-20)16-21(26)24(14-17(2)3)15-19-7-6-13-23(19)4/h5-11,13,17H,1,12,14-16H2,2-4H3