N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]acetamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]acetamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-[4-(2-thenoyl)piperazino]acetamide Formula: C20H22N4O2S2 MolecularWeight: 414.54428

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)CN3CCN(CC3)C(=O)C4=CC=CS4)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)CN3CCN(CC3)C(=O)C4=CC=CS4)C#N

InChI

InChI=1S/C20H22N4O2S2/c21-12-15-14-4-1-2-5-16(14)28-19(15)22-18(25)13-23-7-9-24(10-8-23)20(26)17-6-3-11-27-17/h3,6,11H,1-2,4-5,7-10,13H2,(H,22,25)