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

Systemtic Name: 1-cyclopropyl-3-[1-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]thiourea Openeye Name: 1-cyclopropyl-3-[1-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]thiourea CAS Name: 1-cyclopropyl-3-[1-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]thiourea IUPAC Name: 1-cyclopropyl-3-[1-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]thiourea Traditional Name: 1-cyclopropyl-3-[1-(2-fluorobenzyl)-1,2,4-triazol-3-yl]thiourea Formula: C13H14FN5S MolecularWeight: 291.347163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=S)NC2=NN(C=N2)CC3=CC=CC=C3F

Isomeric SMILES

C1CC1NC(=S)NC2=NN(C=N2)CC3=CC=CC=C3F

InChI

InChI=1S/C13H14FN5S/c14-11-4-2-1-3-9(11)7-19-8-15-12(18-19)17-13(20)16-10-5-6-10/h1-4,8,10H,5-7H2,(H2,16,17,18,20)