6-(1-ethylsulfonylethyl)-8-[3-[3-(4-methylsulfonylphenyl)pyrazin-2-yl]phenyl]quinoline

Systemtic Name: 6-(1-ethylsulfonylethyl)-8-[3-[3-(4-methylsulfonylphenyl)pyrazin-2-yl]phenyl]quinoline Openeye Name: 6-(1-ethylsulfonylethyl)-8-[3-[3-(4-methylsulfonylphenyl)pyrazin-2-yl]phenyl]quinoline CAS Name: 6-(1-ethylsulfonylethyl)-8-[3-[3-(4-methylsulfonylphenyl)-2-pyrazinyl]phenyl]quinoline IUPAC Name: 6-(1-ethylsulfonylethyl)-8-[3-[3-(4-methylsulfonylphenyl)pyrazin-2-yl]phenyl]quinoline Traditional Name: 6-(1-esylethyl)-8-[3-[3-(4-mesylphenyl)pyrazin-2-yl]phenyl]quinoline Formula: C30H27N3O4S2 MolecularWeight: 557.68308

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C(C)C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)C4=NC=CN=C4C5=CC=C(C=C5)S(=O)(=O)C

Isomeric SMILES

CCS(=O)(=O)C(C)C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)C4=NC=CN=C4C5=CC=C(C=C5)S(=O)(=O)C

InChI

InChI=1S/C30H27N3O4S2/c1-4-39(36,37)20(2)25-18-23-9-6-14-31-28(23)27(19-25)22-7-5-8-24(17-22)30-29(32-15-16-33-30)21-10-12-26(13-11-21)38(3,34)35/h5-20H,4H2,1-3H3