(E)-3-(4-methylphenyl)-1-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(4-methylphenyl)-1-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-1-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]-3-(p-tolyl)prop-2-en-1-one CAS Name: (E)-3-(4-methylphenyl)-1-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(4-methylphenyl)-1-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-1-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazino]-3-(p-tolyl)prop-2-en-1-one Formula: C22H28N4O MolecularWeight: 364.48392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)N2CCN(CC2)C3=NC(=NC(=C3)C)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)N2CCN(CC2)C3=NC(=NC(=C3)C)C(C)C

InChI

InChI=1S/C22H28N4O/c1-16(2)22-23-18(4)15-20(24-22)25-11-13-26(14-12-25)21(27)10-9-19-7-5-17(3)6-8-19/h5-10,15-16H,11-14H2,1-4H3/b10-9+