1-(3-chlorophenyl)-3-[(1-methyl-4-nitro-pyrazol-3-yl)carbonylamino]thiourea

Systemtic Name: 1-(3-chlorophenyl)-3-[(1-methyl-4-nitro-pyrazol-3-yl)carbonylamino]thiourea Openeye Name: 1-(3-chlorophenyl)-3-[(1-methyl-4-nitro-pyrazole-3-carbonyl)amino]thiourea CAS Name: 1-(3-chlorophenyl)-3-[[(1-methyl-4-nitro-3-pyrazolyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(3-chlorophenyl)-3-[(1-methyl-4-nitropyrazole-3-carbonyl)amino]thiourea Traditional Name: 1-(3-chlorophenyl)-3-[(1-methyl-4-nitro-pyrazole-3-carbonyl)amino]thiourea Formula: C12H11ClN6O3S MolecularWeight: 354.77214

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)NNC(=S)NC2=CC(=CC=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C(=N1)C(=O)NNC(=S)NC2=CC(=CC=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H11ClN6O3S/c1-18-6-9(19(21)22)10(17-18)11(20)15-16-12(23)14-8-4-2-3-7(13)5-8/h2-6H,1H3,(H,15,20)(H2,14,16,23)