N-[2-(3,4-dimethoxyphenyl)ethyl]-6-methoxy-thieno[2,3-b]quinoline-2-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-methoxy-thieno[2,3-b]quinoline-2-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-methoxy-thieno[2,3-b]quinoline-2-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-methoxy-2-thieno[2,3-b]quinolinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-methoxythieno[2,3-b]quinoline-2-carboxamide Traditional Name: N-homoveratryl-6-methoxy-thieno[2,3-b]quinoline-2-carboxamide Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC3=C(N=C2C=C1)SC(=C3)C(=O)NCCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

COC1=CC2=CC3=C(N=C2C=C1)SC(=C3)C(=O)NCCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C23H22N2O4S/c1-27-17-5-6-18-15(12-17)11-16-13-21(30-23(16)25-18)22(26)24-9-8-14-4-7-19(28-2)20(10-14)29-3/h4-7,10-13H,8-9H2,1-3H3,(H,24,26)