1-butyl-3-[(4-oxidanyl-1-phenyl-pyrazol-3-yl)carbonylamino]thiourea

Systemtic Name: 1-butyl-3-[(4-oxidanyl-1-phenyl-pyrazol-3-yl)carbonylamino]thiourea Openeye Name: 1-butyl-3-[(4-hydroxy-1-phenyl-pyrazole-3-carbonyl)amino]thiourea CAS Name: 1-butyl-3-[[(4-hydroxy-1-phenyl-3-pyrazolyl)-oxomethyl]amino]thiourea IUPAC Name: 1-butyl-3-[(4-hydroxy-1-phenylpyrazole-3-carbonyl)amino]thiourea Traditional Name: 1-butyl-3-[(4-hydroxy-1-phenyl-pyrazole-3-carbonyl)amino]thiourea Formula: C15H19N5O2S MolecularWeight: 333.40866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NNC(=O)C1=NN(C=C1O)C2=CC=CC=C2

Isomeric SMILES

CCCCNC(=S)NNC(=O)C1=NN(C=C1O)C2=CC=CC=C2

InChI

InChI=1S/C15H19N5O2S/c1-2-3-9-16-15(23)18-17-14(22)13-12(21)10-20(19-13)11-7-5-4-6-8-11/h4-8,10,21H,2-3,9H2,1H3,(H,17,22)(H2,16,18,23)