1-(3,4-dimethylphenyl)-2-[6-[(4-methylphenyl)sulfanylmethyl]-4-oxidanylidene-1H-pyrimidin-2-yl]guanidine

Systemtic Name: 1-(3,4-dimethylphenyl)-2-[6-[(4-methylphenyl)sulfanylmethyl]-4-oxidanylidene-1H-pyrimidin-2-yl]guanidine Openeye Name: 1-(3,4-dimethylphenyl)-2-[4-oxo-6-(p-tolylsulfanylmethyl)-1H-pyrimidin-2-yl]guanidine CAS Name: 1-(3,4-dimethylphenyl)-2-[6-[[(4-methylphenyl)thio]methyl]-4-oxo-1H-pyrimidin-2-yl]guanidine IUPAC Name: 1-(3,4-dimethylphenyl)-2-[6-[(4-methylphenyl)sulfanylmethyl]-4-oxo-1H-pyrimidin-2-yl]guanidine Traditional Name: 1-(3,4-dimethylphenyl)-2-[4-keto-6-[(p-tolylthio)methyl]-1H-pyrimidin-2-yl]guanidine Formula: C21H23N5OS MolecularWeight: 393.50522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=CC(=O)N=C(N2)N=C(N)NC3=CC(=C(C=C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=CC(=O)N=C(N2)/N=C(/N)\NC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C21H23N5OS/c1-13-4-8-18(9-5-13)28-12-17-11-19(27)25-21(24-17)26-20(22)23-16-7-6-14(2)15(3)10-16/h4-11H,12H2,1-3H3,(H4,22,23,24,25,26,27)