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

Systemtic Name: 1-(4-methylphenyl)-2-[6-[(4-methylphenyl)sulfanylmethyl]-4-oxidanylidene-1H-pyrimidin-2-yl]guanidine Openeye Name: 2-[4-oxo-6-(p-tolylsulfanylmethyl)-1H-pyrimidin-2-yl]-1-(p-tolyl)guanidine CAS Name: 1-(4-methylphenyl)-2-[6-[[(4-methylphenyl)thio]methyl]-4-oxo-1H-pyrimidin-2-yl]guanidine IUPAC Name: 1-(4-methylphenyl)-2-[6-[(4-methylphenyl)sulfanylmethyl]-4-oxo-1H-pyrimidin-2-yl]guanidine Traditional Name: 2-[4-keto-6-[(p-tolylthio)methyl]-1H-pyrimidin-2-yl]-1-(p-tolyl)guanidine Formula: C20H21N5OS MolecularWeight: 379.47864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=NC2=NC(=O)C=C(N2)CSC3=CC=C(C=C3)C)N

Isomeric SMILES

CC1=CC=C(C=C1)N/C(=N/C2=NC(=O)C=C(N2)CSC3=CC=C(C=C3)C)/N

InChI

InChI=1S/C20H21N5OS/c1-13-3-7-15(8-4-13)22-19(21)25-20-23-16(11-18(26)24-20)12-27-17-9-5-14(2)6-10-17/h3-11H,12H2,1-2H3,(H4,21,22,23,24,25,26)