3,3-bis(ethylsulfanyl)-2-[oxidanyl(quinolin-2-yl)methyl]prop-2-enenitrile

Systemtic Name: 3,3-bis(ethylsulfanyl)-2-[oxidanyl(quinolin-2-yl)methyl]prop-2-enenitrile Openeye Name: 3,3-bis(ethylsulfanyl)-2-[hydroxy(2-quinolyl)methyl]prop-2-enenitrile CAS Name: 3,3-bis(ethylthio)-2-[hydroxy(2-quinolinyl)methyl]-2-propenenitrile IUPAC Name: 3,3-bis(ethylsulfanyl)-2-[hydroxy(quinolin-2-yl)methyl]prop-2-enenitrile Traditional Name: 3,3-bis(ethylthio)-2-[hydroxy(2-quinolyl)methyl]acrylonitrile Formula: C17H18N2OS2 MolecularWeight: 330.46762

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=C(C#N)C(C1=NC2=CC=CC=C2C=C1)O)SCC

Isomeric SMILES

CCSC(=C(C#N)C(C1=NC2=CC=CC=C2C=C1)O)SCC

InChI

InChI=1S/C17H18N2OS2/c1-3-21-17(22-4-2)13(11-18)16(20)15-10-9-12-7-5-6-8-14(12)19-15/h5-10,16,20H,3-4H2,1-2H3