N-(1-azanylethylidene)-4-[4-(1H-pyrrol-2-ylcarbonyl)piperazin-1-yl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-(1-azanylethylidene)-4-[4-(1H-pyrrol-2-ylcarbonyl)piperazin-1-yl]-3-(trifluoromethyl)benzamide Openeye Name: N-(1-aminoethylidene)-4-[4-(1H-pyrrole-2-carbonyl)piperazin-1-yl]-3-(trifluoromethyl)benzamide CAS Name: N-(1-aminoethylidene)-4-[4-[oxo(1H-pyrrol-2-yl)methyl]-1-piperazinyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-(1-aminoethylidene)-4-[4-(1H-pyrrole-2-carbonyl)piperazin-1-yl]-3-(trifluoromethyl)benzamide Traditional Name: N-(1-aminoethylidene)-4-[4-(1H-pyrrole-2-carbonyl)piperazino]-3-(trifluoromethyl)benzamide Formula: C19H20F3N5O2 MolecularWeight: 407.38961

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CN3)C(F)(F)F)N

Isomeric SMILES

CC(=NC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CN3)C(F)(F)F)N

InChI

InChI=1S/C19H20F3N5O2/c1-12(23)25-17(28)13-4-5-16(14(11-13)19(20,21)22)26-7-9-27(10-8-26)18(29)15-3-2-6-24-15/h2-6,11,24H,7-10H2,1H3,(H2,23,25,28)