2-[(3-fluorophenyl)carbamoyl-prop-2-enyl-amino]-N-(2-methylpropyl)-N-[(1-methylpyrrol-2-yl)methyl]ethanamide

Systemtic Name: 2-[(3-fluorophenyl)carbamoyl-prop-2-enyl-amino]-N-(2-methylpropyl)-N-[(1-methylpyrrol-2-yl)methyl]ethanamide Openeye Name: 2-[allyl-[(3-fluorophenyl)carbamoyl]amino]-N-isobutyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide CAS Name: 2-[[(3-fluoroanilino)-oxomethyl]-prop-2-enylamino]-N-(2-methylpropyl)-N-[(1-methyl-2-pyrrolyl)methyl]acetamide IUPAC Name: 2-[(3-fluorophenyl)carbamoyl-prop-2-enylamino]-N-(2-methylpropyl)-N-[(1-methylpyrrol-2-yl)methyl]acetamide Traditional Name: 2-[allyl-[(3-fluorophenyl)carbamoyl]amino]-N-isobutyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide Formula: C22H29FN4O2 MolecularWeight: 400.489663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC=CN1C)C(=O)CN(CC=C)C(=O)NC2=CC(=CC=C2)F

Isomeric SMILES

CC(C)CN(CC1=CC=CN1C)C(=O)CN(CC=C)C(=O)NC2=CC(=CC=C2)F

InChI

InChI=1S/C22H29FN4O2/c1-5-11-26(22(29)24-19-9-6-8-18(23)13-19)16-21(28)27(14-17(2)3)15-20-10-7-12-25(20)4/h5-10,12-13,17H,1,11,14-16H2,2-4H3,(H,24,29)