1-[(4-fluorophenyl)methyl]-3-[(1-phenylpyrazol-4-yl)carbonylamino]thiourea

Systemtic Name: 1-[(4-fluorophenyl)methyl]-3-[(1-phenylpyrazol-4-yl)carbonylamino]thiourea Openeye Name: 1-[(4-fluorophenyl)methyl]-3-[(1-phenylpyrazole-4-carbonyl)amino]thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-3-[[oxo-(1-phenyl-4-pyrazolyl)methyl]amino]thiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-3-[(1-phenylpyrazole-4-carbonyl)amino]thiourea Traditional Name: 1-(4-fluorobenzyl)-3-[(1-phenylpyrazole-4-carbonyl)amino]thiourea Formula: C18H16FN5OS MolecularWeight: 369.415943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)C(=O)NNC(=S)NCC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)C(=O)NNC(=S)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H16FN5OS/c19-15-8-6-13(7-9-15)10-20-18(26)23-22-17(25)14-11-21-24(12-14)16-4-2-1-3-5-16/h1-9,11-12H,10H2,(H,22,25)(H2,20,23,26)