2-[[4-(aminomethyl)phenyl]methylamino]-5-methyl-1H-pyrimidin-6-one

Systemtic Name: 2-[[4-(aminomethyl)phenyl]methylamino]-5-methyl-1H-pyrimidin-6-one Openeye Name: 2-[[4-(aminomethyl)phenyl]methylamino]-5-methyl-1H-pyrimidin-6-one CAS Name: 2-[[4-(aminomethyl)phenyl]methylamino]-5-methyl-1H-pyrimidin-6-one IUPAC Name: 2-[[4-(aminomethyl)phenyl]methylamino]-5-methyl-1H-pyrimidin-6-one Traditional Name: 2-[[4-(aminomethyl)benzyl]amino]-5-methyl-1H-pyrimidin-6-one Formula: C13H16N4O MolecularWeight: 244.29234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(NC1=O)NCC2=CC=C(C=C2)CN

Isomeric SMILES

CC1=CN=C(NC1=O)NCC2=CC=C(C=C2)CN

InChI

InChI=1S/C13H16N4O/c1-9-7-15-13(17-12(9)18)16-8-11-4-2-10(6-14)3-5-11/h2-5,7H,6,8,14H2,1H3,(H2,15,16,17,18)