N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(6-ethoxy-3-methyl-quinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(6-ethoxy-3-methyl-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-[(6-ethoxy-3-methyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(6-ethoxy-3-methyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(6-ethoxy-3-methylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-[(6-ethoxy-3-methyl-2-quinolyl)thio]acetamide Formula: C23H23N3O2S2 MolecularWeight: 437.57762

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=CC(=C(N=C2C=C1)SCC(=O)NC3=C(C4=C(S3)CCCC4)C#N)C

Isomeric SMILES

CCOC1=CC2=CC(=C(N=C2C=C1)SCC(=O)NC3=C(C4=C(S3)CCCC4)C#N)C

InChI

InChI=1S/C23H23N3O2S2/c1-3-28-16-8-9-19-15(11-16)10-14(2)22(25-19)29-13-21(27)26-23-18(12-24)17-6-4-5-7-20(17)30-23/h8-11H,3-7,13H2,1-2H3,(H,26,27)