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

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-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-chloro-2-methyl-phenyl)guanidine CAS Name: 1-(3-chloro-2-methylphenyl)-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-chloro-2-methylphenyl)guanidine Traditional Name: 2-(5-benzyl-4-keto-6-methyl-1H-pyrimidin-2-yl)-1-(3-chloro-2-methyl-phenyl)guanidine Formula: C20H20ClN5O MolecularWeight: 381.8587

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=NC2=NC(=O)C(=C(N2)C)CC3=CC=CC=C3)N

Isomeric SMILES

CC1=C(C=CC=C1Cl)N/C(=N\C2=NC(=O)C(=C(N2)C)CC3=CC=CC=C3)/N

InChI

InChI=1S/C20H20ClN5O/c1-12-16(21)9-6-10-17(12)24-19(22)26-20-23-13(2)15(18(27)25-20)11-14-7-4-3-5-8-14/h3-10H,11H2,1-2H3,(H4,22,23,24,25,26,27)