[2-acetamido-5-(4-chlorophenyl)-6-methyl-pyrimidin-4-yl] carbamimidothioate

Systemtic Name: [2-acetamido-5-(4-chlorophenyl)-6-methyl-pyrimidin-4-yl] carbamimidothioate Openeye Name: N-[4-carbamimidoylsulfanyl-5-(4-chlorophenyl)-6-methyl-pyrimidin-2-yl]acetamide CAS Name: carbamimidothioic acid [2-acetamido-5-(4-chlorophenyl)-6-methyl-4-pyrimidinyl] ester IUPAC Name: [2-acetamido-5-(4-chlorophenyl)-6-methylpyrimidin-4-yl] carbamimidothioate Traditional Name: N-[4-(amidinothio)-5-(4-chlorophenyl)-6-methyl-pyrimidin-2-yl]acetamide Formula: C14H14ClN5OS MolecularWeight: 335.81186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)NC(=O)C)SC(=N)N)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=C(C(=NC(=N1)NC(=O)C)SC(=N)N)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H14ClN5OS/c1-7-11(9-3-5-10(15)6-4-9)12(22-13(16)17)20-14(18-7)19-8(2)21/h3-6H,1-2H3,(H3,16,17)(H,18,19,20,21)