3-[[4-azanyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-bromophenyl)propanamide

Systemtic Name: 3-[[4-azanyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-bromophenyl)propanamide Openeye Name: 3-[[4-amino-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-bromophenyl)propanamide CAS Name: 3-[[4-amino-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]-N-(4-bromophenyl)propanamide IUPAC Name: 3-[[4-amino-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-bromophenyl)propanamide Traditional Name: 3-[[4-amino-5-(2-furyl)-1,2,4-triazol-3-yl]thio]-N-(4-bromophenyl)propionamide Formula: C15H14BrN5O2S MolecularWeight: 408.27296

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=NN=C(N2N)SCCC(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

C1=COC(=C1)C2=NN=C(N2N)SCCC(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C15H14BrN5O2S/c16-10-3-5-11(6-4-10)18-13(22)7-9-24-15-20-19-14(21(15)17)12-2-1-8-23-12/h1-6,8H,7,9,17H2,(H,18,22)