N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-[4-(4-tert-butylphenyl)sulfonylpiperazino]acetamide Formula: C29H40N4O3S2 MolecularWeight: 556.7829

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)CN3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)CN3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C29H40N4O3S2/c1-28(2,3)20-7-10-22(11-8-20)38(35,36)33-15-13-32(14-16-33)19-26(34)31-27-24(18-30)23-12-9-21(29(4,5)6)17-25(23)37-27/h7-8,10-11,21H,9,12-17,19H2,1-6H3,(H,31,34)