N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(7-ethyl-3-methanoyl-indol-1-yl)ethanamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(7-ethyl-3-methanoyl-indol-1-yl)ethanamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(7-ethyl-3-formyl-indol-1-yl)acetamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(7-ethyl-3-formyl-1-indolyl)acetamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(7-ethyl-3-formylindol-1-yl)acetamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(7-ethyl-3-formyl-indol-1-yl)acetamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1N(C=C2C=O)CC(=O)NC3=C(C4=C(S3)CCCC4)C#N

Isomeric SMILES

CCC1=CC=CC2=C1N(C=C2C=O)CC(=O)NC3=C(C4=C(S3)CCCC4)C#N

InChI

InChI=1S/C22H21N3O2S/c1-2-14-6-5-8-16-15(13-26)11-25(21(14)16)12-20(27)24-22-18(10-23)17-7-3-4-9-19(17)28-22/h5-6,8,11,13H,2-4,7,9,12H2,1H3,(H,24,27)