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

Systemtic Name: 1-[(4-oxidanyl-1-phenyl-pyrazol-3-yl)carbonylamino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[(4-hydroxy-1-phenyl-pyrazole-3-carbonyl)amino]thiourea CAS Name: 1-[[(4-hydroxy-1-phenyl-3-pyrazolyl)-oxomethyl]amino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[(4-hydroxy-1-phenylpyrazole-3-carbonyl)amino]thiourea Traditional Name: 1-benzyl-3-[(4-hydroxy-1-phenyl-pyrazole-3-carbonyl)amino]thiourea Formula: C18H17N5O2S MolecularWeight: 367.42488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NNC(=O)C2=NN(C=C2O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NNC(=O)C2=NN(C=C2O)C3=CC=CC=C3

InChI

InChI=1S/C18H17N5O2S/c24-15-12-23(14-9-5-2-6-10-14)22-16(15)17(25)20-21-18(26)19-11-13-7-3-1-4-8-13/h1-10,12,24H,11H2,(H,20,25)(H2,19,21,26)