N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2-quinolin-2-ylsulfanyl-butanamide

Systemtic Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2-quinolin-2-ylsulfanyl-butanamide Openeye Name: N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-2-(2-quinolylsulfanyl)butanamide CAS Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2-(2-quinolinylthio)butanamide IUPAC Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2-quinolin-2-ylsulfanylbutanamide Traditional Name: N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-2-(2-quinolylthio)butyramide Formula: C19H22N4OS2 MolecularWeight: 386.53418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N4OS2/c1-4-15(18(24)21-19-23-22-17(26-19)11-12(2)3)25-16-10-9-13-7-5-6-8-14(13)20-16/h5-10,12,15H,4,11H2,1-3H3,(H,21,23,24)