N-ethyl-2-[[4-ethyl-5-(2-phenylquinolin-4-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylprop-2-enyl)ethanamide

Systemtic Name: N-ethyl-2-[[4-ethyl-5-(2-phenylquinolin-4-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylprop-2-enyl)ethanamide Openeye Name: N-ethyl-2-[[4-ethyl-5-(2-phenyl-4-quinolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylallyl)acetamide CAS Name: N-ethyl-2-[[4-ethyl-5-(2-phenyl-4-quinolinyl)-1,2,4-triazol-3-yl]thio]-N-(2-methylprop-2-enyl)acetamide IUPAC Name: N-ethyl-2-[[4-ethyl-5-(2-phenylquinolin-4-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylprop-2-enyl)acetamide Traditional Name: N-ethyl-2-[[4-ethyl-5-(2-phenyl-4-quinolyl)-1,2,4-triazol-3-yl]thio]-N-(2-methylallyl)acetamide Formula: C27H29N5OS MolecularWeight: 471.61706

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)N(CC)CC(=C)C)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)N(CC)CC(=C)C)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C27H29N5OS/c1-5-31(17-19(3)4)25(33)18-34-27-30-29-26(32(27)6-2)22-16-24(20-12-8-7-9-13-20)28-23-15-11-10-14-21(22)23/h7-16H,3,5-6,17-18H2,1-2,4H3