methyl 4-[6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-[(E)-2-phenylethenyl]pyrimidin-4-yl]piperazine-1-carboxylate

Systemtic Name: methyl 4-[6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-[(E)-2-phenylethenyl]pyrimidin-4-yl]piperazine-1-carboxylate Openeye Name: methyl 4-[6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-[(E)-styryl]pyrimidin-4-yl]piperazine-1-carboxylate CAS Name: 4-[6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-[(E)-2-phenylethenyl]-4-pyrimidinyl]-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-[6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-[(E)-2-phenylethenyl]pyrimidin-4-yl]piperazine-1-carboxylate Traditional Name: 4-[6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-[(E)-styryl]pyrimidin-4-yl]piperazine-1-carboxylic acid methyl ester Formula: C22H25N7O2 MolecularWeight: 419.4796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)NC2=NC(=NC(=C2)N3CCN(CC3)C(=O)OC)C=CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NN1)NC2=NC(=NC(=C2)N3CCN(CC3)C(=O)OC)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C22H25N7O2/c1-16-14-20(27-26-16)24-19-15-21(28-10-12-29(13-11-28)22(30)31-2)25-18(23-19)9-8-17-6-4-3-5-7-17/h3-9,14-15H,10-13H2,1-2H3,(H2,23,24,25,26,27)/b9-8+