3-methyl-2-[(3R)-3-[(phenylmethyl)amino]pyrrolidin-1-yl]-6-pyrimidin-4-yl-pyrimidin-4-one

Systemtic Name: 3-methyl-2-[(3R)-3-[(phenylmethyl)amino]pyrrolidin-1-yl]-6-pyrimidin-4-yl-pyrimidin-4-one Openeye Name: 2-[(3R)-3-(benzylamino)pyrrolidin-1-yl]-3-methyl-6-pyrimidin-4-yl-pyrimidin-4-one CAS Name: 3-methyl-2-[(3R)-3-[(phenylmethyl)amino]-1-pyrrolidinyl]-6-(4-pyrimidinyl)-4-pyrimidinone IUPAC Name: 2-[(3R)-3-(benzylamino)pyrrolidin-1-yl]-3-methyl-6-pyrimidin-4-ylpyrimidin-4-one Traditional Name: 2-[(3R)-3-(benzylamino)pyrrolidino]-3-methyl-6-(4-pyrimidyl)pyrimidin-4-one Formula: C20H22N6O MolecularWeight: 362.42828

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(N=C1N2CCC(C2)NCC3=CC=CC=C3)C4=NC=NC=C4

Isomeric SMILES

CN1C(=O)C=C(N=C1N2CC[C@H](C2)NCC3=CC=CC=C3)C4=NC=NC=C4

InChI

InChI=1S/C20H22N6O/c1-25-19(27)11-18(17-7-9-21-14-23-17)24-20(25)26-10-8-16(13-26)22-12-15-5-3-2-4-6-15/h2-7,9,11,14,16,22H,8,10,12-13H2,1H3/t16-/m1/s1