3-(2-methyl-2,3-dihydroindol-1-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(2-methyl-2,3-dihydroindol-1-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-(2-methylindolin-1-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one CAS Name: 3-(2-methyl-2,3-dihydroindol-1-yl)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(2-methyl-2,3-dihydroindol-1-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-(2-methylindolin-1-yl)-1-[4-(2-pyrimidyl)piperazino]propan-1-one Formula: C20H25N5O MolecularWeight: 351.4454

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1CCC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC1CC2=CC=CC=C2N1CCC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C20H25N5O/c1-16-15-17-5-2-3-6-18(17)25(16)10-7-19(26)23-11-13-24(14-12-23)20-21-8-4-9-22-20/h2-6,8-9,16H,7,10-15H2,1H3