1-(3-bromophenyl)-3-(1H-1,2,4-triazol-5-yl)thiourea

Systemtic Name: 1-(3-bromophenyl)-3-(1H-1,2,4-triazol-5-yl)thiourea Openeye Name: 1-(3-bromophenyl)-3-(1H-1,2,4-triazol-5-yl)thiourea CAS Name: 1-(3-bromophenyl)-3-(1H-1,2,4-triazol-5-yl)thiourea IUPAC Name: 1-(3-bromophenyl)-3-(1H-1,2,4-triazol-5-yl)thiourea Traditional Name: 1-(3-bromophenyl)-3-(1H-1,2,4-triazol-5-yl)thiourea Formula: C9H8BrN5S MolecularWeight: 298.16232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC(=S)NC2=NC=NN2

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC(=S)NC2=NC=NN2

InChI

InChI=1S/C9H8BrN5S/c10-6-2-1-3-7(4-6)13-9(16)14-8-11-5-12-15-8/h1-5H,(H3,11,12,13,14,15,16)