4-[[2,3-bis(chloranyl)phenyl]carbamothioylamino]-2-methyl-pyrazole-3-carboxamide

Systemtic Name: 4-[[2,3-bis(chloranyl)phenyl]carbamothioylamino]-2-methyl-pyrazole-3-carboxamide Openeye Name: 4-[(2,3-dichlorophenyl)carbamothioylamino]-2-methyl-pyrazole-3-carboxamide CAS Name: 4-[[(2,3-dichloroanilino)-sulfanylidenemethyl]amino]-2-methyl-3-pyrazolecarboxamide IUPAC Name: 4-[(2,3-dichlorophenyl)carbamothioylamino]-2-methylpyrazole-3-carboxamide Traditional Name: 4-[(2,3-dichlorophenyl)thiocarbamoylamino]-2-methyl-pyrazole-3-carboxamide Formula: C12H11Cl2N5OS MolecularWeight: 344.21964

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)NC(=S)NC2=C(C(=CC=C2)Cl)Cl)C(=O)N

Isomeric SMILES

CN1C(=C(C=N1)NC(=S)NC2=C(C(=CC=C2)Cl)Cl)C(=O)N

InChI

InChI=1S/C12H11Cl2N5OS/c1-19-10(11(15)20)8(5-16-19)18-12(21)17-7-4-2-3-6(13)9(7)14/h2-5H,1H3,(H2,15,20)(H2,17,18,21)