1-[[3-(4-chlorophenyl)-4-ethyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-2-methyl-3,4-dihydro-2H-quinoline-4-carboxamide

Systemtic Name: 1-[[3-(4-chlorophenyl)-4-ethyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-2-methyl-3,4-dihydro-2H-quinoline-4-carboxamide Openeye Name: 1-[[3-(4-chlorophenyl)-4-ethyl-5-thioxo-1,2,4-triazol-1-yl]methyl]-2-methyl-3,4-dihydro-2H-quinoline-4-carboxamide CAS Name: 1-[[3-(4-chlorophenyl)-4-ethyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-2-methyl-3,4-dihydro-2H-quinoline-4-carboxamide IUPAC Name: 1-[[3-(4-chlorophenyl)-4-ethyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-2-methyl-3,4-dihydro-2H-quinoline-4-carboxamide Traditional Name: 1-[[3-(4-chlorophenyl)-4-ethyl-5-thioxo-1,2,4-triazol-1-yl]methyl]-2-methyl-3,4-dihydro-2H-quinoline-4-carboxamide Formula: C22H24ClN5OS MolecularWeight: 441.97686

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)CN2C(CC(C3=CC=CC=C32)C(=O)N)C)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCN1C(=NN(C1=S)CN2C(CC(C3=CC=CC=C32)C(=O)N)C)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H24ClN5OS/c1-3-26-21(15-8-10-16(23)11-9-15)25-28(22(26)30)13-27-14(2)12-18(20(24)29)17-6-4-5-7-19(17)27/h4-11,14,18H,3,12-13H2,1-2H3,(H2,24,29)