1-[(1,3-dimethylpyrazol-4-yl)carbonylamino]-3-phenyl-thiourea

Systemtic Name: 1-[(1,3-dimethylpyrazol-4-yl)carbonylamino]-3-phenyl-thiourea Openeye Name: 1-[(1,3-dimethylpyrazole-4-carbonyl)amino]-3-phenyl-thiourea CAS Name: 1-[[(1,3-dimethyl-4-pyrazolyl)-oxomethyl]amino]-3-phenylthiourea IUPAC Name: 1-[(1,3-dimethylpyrazole-4-carbonyl)amino]-3-phenylthiourea Traditional Name: 1-[(1,3-dimethylpyrazole-4-carbonyl)amino]-3-phenyl-thiourea Formula: C13H15N5OS MolecularWeight: 289.3561

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C(=O)NNC(=S)NC2=CC=CC=C2)C

Isomeric SMILES

CC1=NN(C=C1C(=O)NNC(=S)NC2=CC=CC=C2)C

InChI

InChI=1S/C13H15N5OS/c1-9-11(8-18(2)17-9)12(19)15-16-13(20)14-10-6-4-3-5-7-10/h3-8H,1-2H3,(H,15,19)(H2,14,16,20)