N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(3,4-dimethoxyphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(3,4-dimethoxyphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-(3,4-dimethoxyphenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(3,4-dimethoxyphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(3,4-dimethoxyphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-(3,4-dimethoxyphenyl)sulfonyl-pyrrolidine-2-carboxamide Formula: C22H25N3O5S2 MolecularWeight: 475.581

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC3=C(C4=C(S3)CCCC4)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC3=C(C4=C(S3)CCCC4)C#N)OC

InChI

InChI=1S/C22H25N3O5S2/c1-29-18-10-9-14(12-19(18)30-2)32(27,28)25-11-5-7-17(25)21(26)24-22-16(13-23)15-6-3-4-8-20(15)31-22/h9-10,12,17H,3-8,11H2,1-2H3,(H,24,26)