[4-(2-azanyl-5-phenyl-pyrimidin-4-yl)-1H-pyrrol-2-yl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: [4-(2-azanyl-5-phenyl-pyrimidin-4-yl)-1H-pyrrol-2-yl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: [4-(2-amino-5-phenyl-pyrimidin-4-yl)-1H-pyrrol-2-yl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [4-(2-amino-5-phenyl-4-pyrimidinyl)-1H-pyrrol-2-yl]-[4-(4-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: [4-(2-amino-5-phenylpyrimidin-4-yl)-1H-pyrrol-2-yl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: [4-(2-amino-5-phenyl-pyrimidin-4-yl)-1H-pyrrol-2-yl]-[4-(4-methoxyphenyl)piperazino]methanone Formula: C26H26N6O2 MolecularWeight: 454.52364

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=CN3)C4=NC(=NC=C4C5=CC=CC=C5)N

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=CN3)C4=NC(=NC=C4C5=CC=CC=C5)N

InChI

InChI=1S/C26H26N6O2/c1-34-21-9-7-20(8-10-21)31-11-13-32(14-12-31)25(33)23-15-19(16-28-23)24-22(17-29-26(27)30-24)18-5-3-2-4-6-18/h2-10,15-17,28H,11-14H2,1H3,(H2,27,29,30)