1-[1-[(3-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-3-phenyl-thiourea

Systemtic Name: 1-[1-[(3-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-3-phenyl-thiourea Openeye Name: 1-[1-[(3-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-3-phenyl-thiourea CAS Name: 1-[1-[(3-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-3-phenylthiourea IUPAC Name: 1-[1-[(3-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-3-phenylthiourea Traditional Name: 1-[1-(3-fluorobenzyl)-1,2,4-triazol-3-yl]-3-phenyl-thiourea Formula: C16H14FN5S MolecularWeight: 327.379263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NC2=NN(C=N2)CC3=CC(=CC=C3)F

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NC2=NN(C=N2)CC3=CC(=CC=C3)F

InChI

InChI=1S/C16H14FN5S/c17-13-6-4-5-12(9-13)10-22-11-18-15(21-22)20-16(23)19-14-7-2-1-3-8-14/h1-9,11H,10H2,(H2,19,20,21,23)