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

Systemtic Name: 1-[1-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-3-phenethyl-thiourea Openeye Name: 1-[1-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-3-phenethyl-thiourea CAS Name: 1-[1-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-3-phenethylthiourea IUPAC Name: 1-[1-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-3-phenethylthiourea Traditional Name: 1-[1-(2-fluorobenzyl)-1,2,4-triazol-3-yl]-3-phenethyl-thiourea Formula: C18H18FN5S MolecularWeight: 355.432423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=S)NC2=NN(C=N2)CC3=CC=CC=C3F

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=S)NC2=NN(C=N2)CC3=CC=CC=C3F

InChI

InChI=1S/C18H18FN5S/c19-16-9-5-4-8-15(16)12-24-13-21-17(23-24)22-18(25)20-11-10-14-6-2-1-3-7-14/h1-9,13H,10-12H2,(H2,20,22,23,25)