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

Systemtic Name: 2-[6-[(4-chlorophenyl)sulfanylmethyl]-4-oxidanylidene-1H-pyrimidin-2-yl]-1-(4-ethoxyphenyl)guanidine Openeye Name: 2-[6-[(4-chlorophenyl)sulfanylmethyl]-4-oxo-1H-pyrimidin-2-yl]-1-(4-ethoxyphenyl)guanidine CAS Name: 2-[6-[[(4-chlorophenyl)thio]methyl]-4-oxo-1H-pyrimidin-2-yl]-1-(4-ethoxyphenyl)guanidine IUPAC Name: 2-[6-[(4-chlorophenyl)sulfanylmethyl]-4-oxo-1H-pyrimidin-2-yl]-1-(4-ethoxyphenyl)guanidine Traditional Name: 2-[6-[[(4-chlorophenyl)thio]methyl]-4-keto-1H-pyrimidin-2-yl]-1-p-phenetyl-guanidine Formula: C20H20ClN5O2S MolecularWeight: 429.9231

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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)Cl)N

Isomeric SMILES

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

InChI

InChI=1S/C20H20ClN5O2S/c1-2-28-16-7-5-14(6-8-16)23-19(22)26-20-24-15(11-18(27)25-20)12-29-17-9-3-13(21)4-10-17/h3-11H,2,12H2,1H3,(H4,22,23,24,25,26,27)