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

Systemtic Name: 1-cyclohexyl-3-[(4-oxidanyl-1-phenyl-pyrazol-3-yl)carbonylamino]thiourea Openeye Name: 1-cyclohexyl-3-[(4-hydroxy-1-phenyl-pyrazole-3-carbonyl)amino]thiourea CAS Name: 1-cyclohexyl-3-[[(4-hydroxy-1-phenyl-3-pyrazolyl)-oxomethyl]amino]thiourea IUPAC Name: 1-cyclohexyl-3-[(4-hydroxy-1-phenylpyrazole-3-carbonyl)amino]thiourea Traditional Name: 1-cyclohexyl-3-[(4-hydroxy-1-phenyl-pyrazole-3-carbonyl)amino]thiourea Formula: C17H21N5O2S MolecularWeight: 359.44594

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NNC(=O)C2=NN(C=C2O)C3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)NC(=S)NNC(=O)C2=NN(C=C2O)C3=CC=CC=C3

InChI

InChI=1S/C17H21N5O2S/c23-14-11-22(13-9-5-2-6-10-13)21-15(14)16(24)19-20-17(25)18-12-7-3-1-4-8-12/h2,5-6,9-12,23H,1,3-4,7-8H2,(H,19,24)(H2,18,20,25)