N-(3-butylsulfanylpropyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide

Systemtic Name: N-(3-butylsulfanylpropyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide Openeye Name: N-(3-butylsulfanylpropyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide CAS Name: N-[3-(butylthio)propyl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]-4-quinolinecarboxamide IUPAC Name: N-(3-butylsulfanylpropyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide Traditional Name: N-[3-(butylthio)propyl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]cinchoninamide Formula: C20H24N4OS3 MolecularWeight: 432.62576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCCCNC(=O)C1=CC(=NC2=CC=CC=C21)SC3=NN=C(S3)C

Isomeric SMILES

CCCCSCCCNC(=O)C1=CC(=NC2=CC=CC=C21)SC3=NN=C(S3)C

InChI

InChI=1S/C20H24N4OS3/c1-3-4-11-26-12-7-10-21-19(25)16-13-18(28-20-24-23-14(2)27-20)22-17-9-6-5-8-15(16)17/h5-6,8-9,13H,3-4,7,10-12H2,1-2H3,(H,21,25)