2-(4,8-dimethylquinolin-2-yl)sulfanyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide

Systemtic Name: 2-(4,8-dimethylquinolin-2-yl)sulfanyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: 2-[(4,8-dimethyl-2-quinolyl)sulfanyl]-N-(5-isobutyl-1,3,4-thiadiazol-2-yl)butanamide CAS Name: 2-[(4,8-dimethyl-2-quinolinyl)thio]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: 2-(4,8-dimethylquinolin-2-yl)sulfanyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide Traditional Name: 2-[(4,8-dimethyl-2-quinolyl)thio]-N-(5-isobutyl-1,3,4-thiadiazol-2-yl)butyramide Formula: C21H26N4OS2 MolecularWeight: 414.58734

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NN=C(S1)CC(C)C)SC2=NC3=C(C=CC=C3C)C(=C2)C

Isomeric SMILES

CCC(C(=O)NC1=NN=C(S1)CC(C)C)SC2=NC3=C(C=CC=C3C)C(=C2)C

InChI

InChI=1S/C21H26N4OS2/c1-6-16(20(26)23-21-25-24-18(28-21)10-12(2)3)27-17-11-14(5)15-9-7-8-13(4)19(15)22-17/h7-9,11-12,16H,6,10H2,1-5H3,(H,23,25,26)