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

Systemtic Name: 1-(3,4-dimethylphenyl)-2-[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]guanidine Openeye Name: 2-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-1-(3,4-dimethylphenyl)guanidine CAS Name: 1-(3,4-dimethylphenyl)-2-[6-methyl-4-oxo-5-(phenylmethyl)-1H-pyrimidin-2-yl]guanidine IUPAC Name: 2-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-1-(3,4-dimethylphenyl)guanidine Traditional Name: 2-(5-benzyl-4-keto-6-methyl-1H-pyrimidin-2-yl)-1-(3,4-dimethylphenyl)guanidine Formula: C21H23N5O MolecularWeight: 361.44022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N5O/c1-13-9-10-17(11-14(13)2)24-20(22)26-21-23-15(3)18(19(27)25-21)12-16-7-5-4-6-8-16/h4-11H,12H2,1-3H3,(H4,22,23,24,25,26,27)