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

Systemtic Name: N-(3,4-dichlorophenyl)-2-[(4-prop-2-enyl-5-quinolin-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[[4-allyl-5-(2-quinolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3,4-dichlorophenyl)acetamide CAS Name: N-(3,4-dichlorophenyl)-2-[[4-prop-2-enyl-5-(2-quinolinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(3,4-dichlorophenyl)-2-[(4-prop-2-enyl-5-quinolin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[[4-allyl-5-(2-quinolyl)-1,2,4-triazol-3-yl]thio]-N-(3,4-dichlorophenyl)acetamide Formula: C22H17Cl2N5OS MolecularWeight: 470.37428

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)Cl)Cl)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)Cl)Cl)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H17Cl2N5OS/c1-2-11-29-21(19-10-7-14-5-3-4-6-18(14)26-19)27-28-22(29)31-13-20(30)25-15-8-9-16(23)17(24)12-15/h2-10,12H,1,11,13H2,(H,25,30)