1-[(2,5-dimethyl-4-nitro-pyrazol-3-yl)carbonylamino]-3-(4-methylphenyl)thiourea

Systemtic Name: 1-[(2,5-dimethyl-4-nitro-pyrazol-3-yl)carbonylamino]-3-(4-methylphenyl)thiourea Openeye Name: 1-[(2,5-dimethyl-4-nitro-pyrazole-3-carbonyl)amino]-3-(p-tolyl)thiourea CAS Name: 1-[[(2,5-dimethyl-4-nitro-3-pyrazolyl)-oxomethyl]amino]-3-(4-methylphenyl)thiourea IUPAC Name: 1-[(2,5-dimethyl-4-nitropyrazole-3-carbonyl)amino]-3-(4-methylphenyl)thiourea Traditional Name: 1-[(2,5-dimethyl-4-nitro-pyrazole-3-carbonyl)amino]-3-(p-tolyl)thiourea Formula: C14H16N6O3S MolecularWeight: 348.38024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NNC(=O)C2=C(C(=NN2C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NNC(=O)C2=C(C(=NN2C)C)[N+](=O)[O-]

InChI

InChI=1S/C14H16N6O3S/c1-8-4-6-10(7-5-8)15-14(24)17-16-13(21)12-11(20(22)23)9(2)18-19(12)3/h4-7H,1-3H3,(H,16,21)(H2,15,17,24)