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

Systemtic Name: N-(2-bromophenyl)-2-[[5-(3-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-allyl-5-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-bromophenyl)acetamide CAS Name: N-(2-bromophenyl)-2-[[5-(3-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-bromophenyl)-2-[[5-(3-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-allyl-5-(3-chlorophenyl)-1,2,4-triazol-3-yl]thio]-N-(2-bromophenyl)acetamide Formula: C19H16BrClN4OS MolecularWeight: 463.77854

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2Br)C3=CC(=CC=C3)Cl

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2Br)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H16BrClN4OS/c1-2-10-25-18(13-6-5-7-14(21)11-13)23-24-19(25)27-12-17(26)22-16-9-4-3-8-15(16)20/h2-9,11H,1,10,12H2,(H,22,26)