(E)-4-[6-methyl-2-[3-[(4-methylpyrimidin-2-yl)amino]propylimino]pyrimidin-1-yl]but-3-en-2-one

Systemtic Name: (E)-4-[6-methyl-2-[3-[(4-methylpyrimidin-2-yl)amino]propylimino]pyrimidin-1-yl]but-3-en-2-one Openeye Name: (E)-4-[6-methyl-2-[3-[(4-methylpyrimidin-2-yl)amino]propylimino]pyrimidin-1-yl]but-3-en-2-one CAS Name: (E)-4-[6-methyl-2-[3-[(4-methyl-2-pyrimidinyl)amino]propylimino]-1-pyrimidinyl]-3-buten-2-one IUPAC Name: (E)-4-[6-methyl-2-[3-[(4-methylpyrimidin-2-yl)amino]propylimino]pyrimidin-1-yl]but-3-en-2-one Traditional Name: (E)-4-[6-methyl-2-[3-[(4-methylpyrimidin-2-yl)amino]propylimino]pyrimidin-1-yl]but-3-en-2-one Formula: C17H22N6O MolecularWeight: 326.39618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)NCCCN=C2N=CC=C(N2C=CC(=O)C)C

Isomeric SMILES

CC1=NC(=NC=C1)NCCCN=C2N=CC=C(N2/C=C/C(=O)C)C

InChI

InChI=1S/C17H22N6O/c1-13-5-10-19-16(22-13)18-8-4-9-20-17-21-11-6-14(2)23(17)12-7-15(3)24/h5-7,10-12H,4,8-9H2,1-3H3,(H,18,19,22)/b12-7+,20-17?