N-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]-4-pyrimidin-2-yl-piperazine-1-carboxamide

Systemtic Name: N-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]-4-pyrimidin-2-yl-piperazine-1-carboxamide Openeye Name: N-[1-(3-isopropenylphenyl)-1-methyl-ethyl]-4-pyrimidin-2-yl-piperazine-1-carboxamide CAS Name: N-[2-[3-(1-methylethenyl)phenyl]propan-2-yl]-4-(2-pyrimidinyl)-1-piperazinecarboxamide IUPAC Name: N-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]-4-pyrimidin-2-ylpiperazine-1-carboxamide Traditional Name: N-[1-(3-isopropenylphenyl)-1-methyl-ethyl]-4-(2-pyrimidyl)piperazine-1-carboxamide Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C21H27N5O/c1-16(2)17-7-5-8-18(15-17)21(3,4)24-20(27)26-13-11-25(12-14-26)19-22-9-6-10-23-19/h5-10,15H,1,11-14H2,2-4H3,(H,24,27)