6-ethoxy-2-[2-oxidanylidene-2-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)ethyl]sulfanyl-quinoline-3-carbonitrile

Systemtic Name: 6-ethoxy-2-[2-oxidanylidene-2-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)ethyl]sulfanyl-quinoline-3-carbonitrile Openeye Name: 6-ethoxy-2-[2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl]sulfanyl-quinoline-3-carbonitrile CAS Name: 6-ethoxy-2-[[2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl]thio]-3-quinolinecarbonitrile IUPAC Name: 6-ethoxy-2-[2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl]sulfanylquinoline-3-carbonitrile Traditional Name: 6-ethoxy-2-[[2-keto-2-(3-keto-2,4-dihydroquinoxalin-1-yl)ethyl]thio]quinoline-3-carbonitrile Formula: C22H18N4O3S MolecularWeight: 418.46832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)N3CC(=O)NC4=CC=CC=C43

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)N3CC(=O)NC4=CC=CC=C43

InChI

InChI=1S/C22H18N4O3S/c1-2-29-16-7-8-17-14(10-16)9-15(11-23)22(25-17)30-13-21(28)26-12-20(27)24-18-5-3-4-6-19(18)26/h3-10H,2,12-13H2,1H3,(H,24,27)