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

Systemtic Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-[4-(4-methoxyphenyl)sulfonylpiperazino]acetamide Formula: C26H34N4O4S2 MolecularWeight: 530.70256

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C26H34N4O4S2/c1-26(2,3)18-5-10-21-22(16-27)25(35-23(21)15-18)28-24(31)17-29-11-13-30(14-12-29)36(32,33)20-8-6-19(34-4)7-9-20/h6-9,18H,5,10-15,17H2,1-4H3,(H,28,31)