4-[3-(3-cyanopropylsulfanyl)quinoxalin-2-yl]sulfanylbutanenitrile

Systemtic Name: 4-[3-(3-cyanopropylsulfanyl)quinoxalin-2-yl]sulfanylbutanenitrile Openeye Name: 4-[3-(3-cyanopropylsulfanyl)quinoxalin-2-yl]sulfanylbutanenitrile CAS Name: 4-[[3-(3-cyanopropylthio)-2-quinoxalinyl]thio]butanenitrile IUPAC Name: 4-[3-(3-cyanopropylsulfanyl)quinoxalin-2-yl]sulfanylbutanenitrile Traditional Name: 4-[[3-(3-cyanopropylthio)quinoxalin-2-yl]thio]butyronitrile Formula: C16H16N4S2 MolecularWeight: 328.45504

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(C(=N2)SCCCC#N)SCCCC#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(C(=N2)SCCCC#N)SCCCC#N

InChI

InChI=1S/C16H16N4S2/c17-9-3-5-11-21-15-16(22-12-6-4-10-18)20-14-8-2-1-7-13(14)19-15/h1-2,7-8H,3-6,11-12H2