1-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-3-[(4-iodanyl-1H-pyrazol-5-yl)carbonylamino]thiourea

Systemtic Name: 1-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-3-[(4-iodanyl-1H-pyrazol-5-yl)carbonylamino]thiourea Openeye Name: 1-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-3-[(4-iodo-1H-pyrazole-5-carbonyl)amino]thiourea CAS Name: 1-[1-[(2-fluorophenyl)methyl]-3-pyrazolyl]-3-[[(4-iodo-1H-pyrazol-5-yl)-oxomethyl]amino]thiourea IUPAC Name: 1-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-3-[(4-iodo-1H-pyrazole-5-carbonyl)amino]thiourea Traditional Name: 1-[1-(2-fluorobenzyl)pyrazol-3-yl]-3-[(4-iodo-1H-pyrazole-5-carbonyl)amino]thiourea Formula: C15H13FIN7OS MolecularWeight: 485.277893

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=CC(=N2)NC(=S)NNC(=O)C3=C(C=NN3)I)F

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=CC(=N2)NC(=S)NNC(=O)C3=C(C=NN3)I)F

InChI

InChI=1S/C15H13FIN7OS/c16-10-4-2-1-3-9(10)8-24-6-5-12(23-24)19-15(26)22-21-14(25)13-11(17)7-18-20-13/h1-7H,8H2,(H,18,20)(H,21,25)(H2,19,22,23,26)