2-[4-(3-methylbutylsulfanyl)phenyl]quinoxaline

Systemtic Name: 2-[4-(3-methylbutylsulfanyl)phenyl]quinoxaline Openeye Name: 2-(4-isopentylsulfanylphenyl)quinoxaline CAS Name: 2-[4-(3-methylbutylthio)phenyl]quinoxaline IUPAC Name: 2-[4-(3-methylbutylsulfanyl)phenyl]quinoxaline Traditional Name: 2-[4-(isoamylthio)phenyl]quinoxaline Formula: C19H20N2S MolecularWeight: 308.4405

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=CC=C(C=C1)C2=NC3=CC=CC=C3N=C2

Isomeric SMILES

CC(C)CCSC1=CC=C(C=C1)C2=NC3=CC=CC=C3N=C2

InChI

InChI=1S/C19H20N2S/c1-14(2)11-12-22-16-9-7-15(8-10-16)19-13-20-17-5-3-4-6-18(17)21-19/h3-10,13-14H,11-12H2,1-2H3