1-(3-chlorophenyl)-3-(1,2,4-triazol-4-yl)thiourea

Systemtic Name: 1-(3-chlorophenyl)-3-(1,2,4-triazol-4-yl)thiourea Openeye Name: 1-(3-chlorophenyl)-3-(1,2,4-triazol-4-yl)thiourea CAS Name: 1-(3-chlorophenyl)-3-(1,2,4-triazol-4-yl)thiourea IUPAC Name: 1-(3-chlorophenyl)-3-(1,2,4-triazol-4-yl)thiourea Traditional Name: 1-(3-chlorophenyl)-3-(1,2,4-triazol-4-yl)thiourea Formula: C9H8ClN5S MolecularWeight: 253.71132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC(=S)NN2C=NN=C2

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC(=S)NN2C=NN=C2

InChI

InChI=1S/C9H8ClN5S/c10-7-2-1-3-8(4-7)13-9(16)14-15-5-11-12-6-15/h1-6H,(H2,13,14,16)