[2-[(E)-2-benzamido-3-[(4-methylpyrimidin-2-yl)amino]prop-2-enoyl]hydrazinyl]methylidene-dimethyl-azanium

Systemtic Name: [2-[(E)-2-benzamido-3-[(4-methylpyrimidin-2-yl)amino]prop-2-enoyl]hydrazinyl]methylidene-dimethyl-azanium Openeye Name: [2-[(E)-2-benzamido-3-[(4-methylpyrimidin-2-yl)amino]prop-2-enoyl]hydrazino]methylene-dimethyl-ammonium CAS Name: [[(E)-2-benzamido-3-[(4-methyl-2-pyrimidinyl)amino]-1-oxoprop-2-enyl]hydrazo]methylidene-dimethylammonium IUPAC Name: [2-[(E)-2-benzamido-3-[(4-methylpyrimidin-2-yl)amino]prop-2-enoyl]hydrazinyl]methylidene-dimethylazanium Traditional Name: [N'-[(E)-2-benzamido-3-[(4-methylpyrimidin-2-yl)amino]acryloyl]hydrazino]methylene-dimethyl-ammonium Formula: C18H22N7O2+ MolecularWeight: 368.41298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)NC=C(C(=O)NNC=[N+](C)C)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=NC(=NC=C1)N/C=C(\C(=O)NNC=[N+](C)C)/NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H21N7O2/c1-13-9-10-19-18(22-13)20-11-15(17(27)24-21-12-25(2)3)23-16(26)14-7-5-4-6-8-14/h4-12H,1-3H3,(H3,19,20,22,23,24,26,27)/p+1