1-(1,3-dimethyl-5-phenyl-pyrazol-4-yl)thiourea

Systemtic Name: 1-(1,3-dimethyl-5-phenyl-pyrazol-4-yl)thiourea Openeye Name: (1,3-dimethyl-5-phenyl-pyrazol-4-yl)thiourea CAS Name: (1,3-dimethyl-5-phenyl-4-pyrazolyl)thiourea IUPAC Name: (1,3-dimethyl-5-phenylpyrazol-4-yl)thiourea Traditional Name: (1,3-dimethyl-5-phenyl-pyrazol-4-yl)thiourea Formula: C12H14N4S MolecularWeight: 246.33136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1NC(=S)N)C2=CC=CC=C2)C

Isomeric SMILES

CC1=NN(C(=C1NC(=S)N)C2=CC=CC=C2)C

InChI

InChI=1S/C12H14N4S/c1-8-10(14-12(13)17)11(16(2)15-8)9-6-4-3-5-7-9/h3-7H,1-2H3,(H3,13,14,17)