2-[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]-1-(3-methylphenyl)guanidine

Systemtic Name: 2-[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]-1-(3-methylphenyl)guanidine Openeye Name: 2-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-1-(m-tolyl)guanidine CAS Name: 2-[6-methyl-4-oxo-5-(phenylmethyl)-1H-pyrimidin-2-yl]-1-(3-methylphenyl)guanidine IUPAC Name: 2-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-1-(3-methylphenyl)guanidine Traditional Name: 2-(5-benzyl-4-keto-6-methyl-1H-pyrimidin-2-yl)-1-(m-tolyl)guanidine Formula: C20H21N5O MolecularWeight: 347.41364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=NC2=NC(=O)C(=C(N2)C)CC3=CC=CC=C3)N

Isomeric SMILES

CC1=CC(=CC=C1)N/C(=N/C2=NC(=O)C(=C(N2)C)CC3=CC=CC=C3)/N

InChI

InChI=1S/C20H21N5O/c1-13-7-6-10-16(11-13)23-19(21)25-20-22-14(2)17(18(26)24-20)12-15-8-4-3-5-9-15/h3-11H,12H2,1-2H3,(H4,21,22,23,24,25,26)