2-ethylsulfanylcarbothioylsulfanyl-1-[5-[5-[(quinolin-4-ylamino)methyl]pyridin-2-yl]thiophen-2-yl]ethanone

Systemtic Name: 2-ethylsulfanylcarbothioylsulfanyl-1-[5-[5-[(quinolin-4-ylamino)methyl]pyridin-2-yl]thiophen-2-yl]ethanone Openeye Name: 2-ethylsulfanylcarbothioylsulfanyl-1-[5-[5-[(4-quinolylamino)methyl]-2-pyridyl]-2-thienyl]ethanone CAS Name: 2-[[(ethylthio)-sulfanylidenemethyl]thio]-1-[5-[5-[(4-quinolinylamino)methyl]-2-pyridinyl]-2-thiophenyl]ethanone IUPAC Name: 2-ethylsulfanylcarbothioylsulfanyl-1-[5-[5-[(quinolin-4-ylamino)methyl]pyridin-2-yl]thiophen-2-yl]ethanone Traditional Name: 2-[(ethylthio)carbothioylthio]-1-[5-[5-[(4-quinolylamino)methyl]-2-pyridyl]-2-thienyl]ethanone Formula: C24H21N3OS4 MolecularWeight: 495.70304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC(=S)SCC(=O)C1=CC=C(S1)C2=NC=C(C=C2)CNC3=CC=NC4=CC=CC=C43

Isomeric SMILES

CCSC(=S)SCC(=O)C1=CC=C(S1)C2=NC=C(C=C2)CNC3=CC=NC4=CC=CC=C43

InChI

InChI=1S/C24H21N3OS4/c1-2-30-24(29)31-15-21(28)23-10-9-22(32-23)20-8-7-16(14-27-20)13-26-19-11-12-25-18-6-4-3-5-17(18)19/h3-12,14H,2,13,15H2,1H3,(H,25,26)