(7-methoxy-4,5-dihydro-2H-benzo[g]indazol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (7-methoxy-4,5-dihydro-2H-benzo[g]indazol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (7-methoxy-4,5-dihydro-2H-benzo[g]indazol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (7-methoxy-4,5-dihydro-2H-benzo[g]indazol-3-yl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (7-methoxy-4,5-dihydro-2H-benzo[g]indazol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (7-methoxy-4,5-dihydro-2H-benz[g]indazol-3-yl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C21H22N6O2 MolecularWeight: 390.43838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=NNC(=C3CC2)C(=O)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

COC1=CC2=C(C=C1)C3=NNC(=C3CC2)C(=O)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C21H22N6O2/c1-29-15-4-6-16-14(13-15)3-5-17-18(16)24-25-19(17)20(28)26-9-11-27(12-10-26)21-22-7-2-8-23-21/h2,4,6-8,13H,3,5,9-12H2,1H3,(H,24,25)