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

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-[(4-oxidanyl-1-phenyl-pyrazol-3-yl)carbonylamino]thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-[(4-hydroxy-1-phenyl-pyrazole-3-carbonyl)amino]thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[[(4-hydroxy-1-phenyl-3-pyrazolyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-[(4-hydroxy-1-phenylpyrazole-3-carbonyl)amino]thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-[(4-hydroxy-1-phenyl-pyrazole-3-carbonyl)amino]thiourea Formula: C17H13ClFN5O2S MolecularWeight: 405.833823

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C(=O)NNC(=S)NC3=CC(=C(C=C3)F)Cl)O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C(=O)NNC(=S)NC3=CC(=C(C=C3)F)Cl)O

InChI

InChI=1S/C17H13ClFN5O2S/c18-12-8-10(6-7-13(12)19)20-17(27)22-21-16(26)15-14(25)9-24(23-15)11-4-2-1-3-5-11/h1-9,25H,(H,21,26)(H2,20,22,27)