6-(4-methylphenyl)-2-octylsulfonyl-4-phenyl-thieno[2,3-b]pyridin-3-amine

Systemtic Name: 6-(4-methylphenyl)-2-octylsulfonyl-4-phenyl-thieno[2,3-b]pyridin-3-amine Openeye Name: 2-octylsulfonyl-4-phenyl-6-(p-tolyl)thieno[2,3-b]pyridin-3-amine CAS Name: 6-(4-methylphenyl)-2-octylsulfonyl-4-phenyl-3-thieno[2,3-b]pyridinamine IUPAC Name: 6-(4-methylphenyl)-2-octylsulfonyl-4-phenylthieno[2,3-b]pyridin-3-amine Traditional Name: [2-octylsulfonyl-4-phenyl-6-(p-tolyl)thieno[2,3-b]pyridin-3-yl]amine Formula: C28H32N2O2S2 MolecularWeight: 492.69588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)C1=C(C2=C(S1)N=C(C=C2C3=CC=CC=C3)C4=CC=C(C=C4)C)N

Isomeric SMILES

CCCCCCCCS(=O)(=O)C1=C(C2=C(S1)N=C(C=C2C3=CC=CC=C3)C4=CC=C(C=C4)C)N

InChI

InChI=1S/C28H32N2O2S2/c1-3-4-5-6-7-11-18-34(31,32)28-26(29)25-23(21-12-9-8-10-13-21)19-24(30-27(25)33-28)22-16-14-20(2)15-17-22/h8-10,12-17,19H,3-7,11,18,29H2,1-2H3