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

Systemtic Name: (E)-3-(4-chlorophenyl)-1-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(4-chlorophenyl)-1-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(4-chlorophenyl)-1-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(4-chlorophenyl)-1-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(4-chlorophenyl)-1-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazino]prop-2-en-1-one Formula: C21H25ClN4O MolecularWeight: 384.9024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)C=CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)/C=C/C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H25ClN4O/c1-15(2)21-23-16(3)14-19(24-21)25-10-12-26(13-11-25)20(27)9-6-17-4-7-18(22)8-5-17/h4-9,14-15H,10-13H2,1-3H3/b9-6+