N-aminocarbonyl-2-[[5-(4-bromophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-aminocarbonyl-2-[[5-(4-bromophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-allyl-5-(4-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-carbamoyl-acetamide CAS Name: 2-[[5-(4-bromophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-N-carbamoylacetamide IUPAC Name: 2-[[5-(4-bromophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-carbamoylacetamide Traditional Name: 2-[[4-allyl-5-(4-bromophenyl)-1,2,4-triazol-3-yl]thio]-N-carbamoyl-acetamide Formula: C14H14BrN5O2S MolecularWeight: 396.26226

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)NC(=O)N)C2=CC=C(C=C2)Br

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)NC(=O)N)C2=CC=C(C=C2)Br

InChI

InChI=1S/C14H14BrN5O2S/c1-2-7-20-12(9-3-5-10(15)6-4-9)18-19-14(20)23-8-11(21)17-13(16)22/h2-6H,1,7-8H2,(H3,16,17,21,22)