1-phenyl-3-(1,3,5-trimethylpyrazol-4-yl)thiourea

Systemtic Name: 1-phenyl-3-(1,3,5-trimethylpyrazol-4-yl)thiourea Openeye Name: 1-phenyl-3-(1,3,5-trimethylpyrazol-4-yl)thiourea CAS Name: 1-phenyl-3-(1,3,5-trimethyl-4-pyrazolyl)thiourea IUPAC Name: 1-phenyl-3-(1,3,5-trimethylpyrazol-4-yl)thiourea Traditional Name: 1-phenyl-3-(1,3,5-trimethylpyrazol-4-yl)thiourea Formula: C13H16N4S MolecularWeight: 260.35794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=S)NC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=S)NC2=CC=CC=C2

InChI

InChI=1S/C13H16N4S/c1-9-12(10(2)17(3)16-9)15-13(18)14-11-7-5-4-6-8-11/h4-8H,1-3H3,(H2,14,15,18)