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

Systemtic Name: 1-(4-ethoxyphenyl)-2-[6-[(4-methylphenyl)sulfanylmethyl]-4-oxidanylidene-1H-pyrimidin-2-yl]guanidine Openeye Name: 1-(4-ethoxyphenyl)-2-[4-oxo-6-(p-tolylsulfanylmethyl)-1H-pyrimidin-2-yl]guanidine CAS Name: 1-(4-ethoxyphenyl)-2-[6-[[(4-methylphenyl)thio]methyl]-4-oxo-1H-pyrimidin-2-yl]guanidine IUPAC Name: 1-(4-ethoxyphenyl)-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-phenetyl-guanidine Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=NC2=NC(=O)C=C(N2)CSC3=CC=C(C=C3)C)N

Isomeric SMILES

CCOC1=CC=C(C=C1)N/C(=N/C2=NC(=O)C=C(N2)CSC3=CC=C(C=C3)C)/N

InChI

InChI=1S/C21H23N5O2S/c1-3-28-17-8-6-15(7-9-17)23-20(22)26-21-24-16(12-19(27)25-21)13-29-18-10-4-14(2)5-11-18/h4-12H,3,13H2,1-2H3,(H4,22,23,24,25,26,27)