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

Systemtic Name: N-[1-(4-butoxyphenyl)ethyl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide Openeye Name: N-[1-(4-butoxyphenyl)ethyl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide CAS Name: N-[1-(4-butoxyphenyl)ethyl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]-4-quinolinecarboxamide IUPAC Name: N-[1-(4-butoxyphenyl)ethyl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide Traditional Name: N-[1-(4-butoxyphenyl)ethyl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]cinchoninamide Formula: C25H26N4O2S2 MolecularWeight: 478.62954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(C)NC(=O)C2=CC(=NC3=CC=CC=C32)SC4=NN=C(S4)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(C)NC(=O)C2=CC(=NC3=CC=CC=C32)SC4=NN=C(S4)C

InChI

InChI=1S/C25H26N4O2S2/c1-4-5-14-31-19-12-10-18(11-13-19)16(2)26-24(30)21-15-23(33-25-29-28-17(3)32-25)27-22-9-7-6-8-20(21)22/h6-13,15-16H,4-5,14H2,1-3H3,(H,26,30)