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

Systemtic Name: 1-[1-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-3-propan-2-yl-thiourea Openeye Name: 1-[1-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-3-isopropyl-thiourea CAS Name: 1-[1-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-3-propan-2-ylthiourea IUPAC Name: 1-[1-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-3-propan-2-ylthiourea Traditional Name: 1-[1-(2-fluorobenzyl)-1,2,4-triazol-3-yl]-3-isopropyl-thiourea Formula: C13H16FN5S MolecularWeight: 293.363043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NC1=NN(C=N1)CC2=CC=CC=C2F

Isomeric SMILES

CC(C)NC(=S)NC1=NN(C=N1)CC2=CC=CC=C2F

InChI

InChI=1S/C13H16FN5S/c1-9(2)16-13(20)17-12-15-8-19(18-12)7-10-5-3-4-6-11(10)14/h3-6,8-9H,7H2,1-2H3,(H2,16,17,18,20)