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

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(2,3-dimethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-(2,3-dimethylphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(2,3-dimethylphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(2,3-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-(2,3-dimethylphenyl)-5-keto-pyrrolidine-3-carboxamide Formula: C22H23N3O2S MolecularWeight: 393.50192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CC(CC2=O)C(=O)NC3=C(C4=C(S3)CCCC4)C#N)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CC(CC2=O)C(=O)NC3=C(C4=C(S3)CCCC4)C#N)C

InChI

InChI=1S/C22H23N3O2S/c1-13-6-5-8-18(14(13)2)25-12-15(10-20(25)26)21(27)24-22-17(11-23)16-7-3-4-9-19(16)28-22/h5-6,8,15H,3-4,7,9-10,12H2,1-2H3,(H,24,27)