3-methyl-5-(3-methylphenyl)-2-[2-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]-6-pyridin-4-yl-pyrimidin-4-one

Systemtic Name: 3-methyl-5-(3-methylphenyl)-2-[2-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]-6-pyridin-4-yl-pyrimidin-4-one Openeye Name: 2-[2-[(isopropylamino)methyl]pyrrolidin-1-yl]-3-methyl-5-(m-tolyl)-6-(4-pyridyl)pyrimidin-4-one CAS Name: 3-methyl-5-(3-methylphenyl)-2-[2-[(propan-2-ylamino)methyl]-1-pyrrolidinyl]-6-pyridin-4-yl-4-pyrimidinone IUPAC Name: 3-methyl-5-(3-methylphenyl)-2-[2-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]-6-pyridin-4-ylpyrimidin-4-one Traditional Name: 2-[2-[(isopropylamino)methyl]pyrrolidino]-3-methyl-5-(m-tolyl)-6-(4-pyridyl)pyrimidin-4-one Formula: C25H31N5O MolecularWeight: 417.54654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(N=C(N(C2=O)C)N3CCCC3CNC(C)C)C4=CC=NC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(N=C(N(C2=O)C)N3CCCC3CNC(C)C)C4=CC=NC=C4

InChI

InChI=1S/C25H31N5O/c1-17(2)27-16-21-9-6-14-30(21)25-28-23(19-10-12-26-13-11-19)22(24(31)29(25)4)20-8-5-7-18(3)15-20/h5,7-8,10-13,15,17,21,27H,6,9,14,16H2,1-4H3