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

Systemtic Name: N-(4-bromophenyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(4-bromophenyl)-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-(4-bromophenyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(4-bromophenyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(4-bromophenyl)-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]propionamide Formula: C15H13BrN4OS2 MolecularWeight: 409.32392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)Br)SC2=NNC(=N2)C3=CC=CS3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)Br)SC2=NNC(=N2)C3=CC=CS3

InChI

InChI=1S/C15H13BrN4OS2/c1-9(14(21)17-11-6-4-10(16)5-7-11)23-15-18-13(19-20-15)12-3-2-8-22-12/h2-9H,1H3,(H,17,21)(H,18,19,20)