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

Systemtic Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]ethanamide Openeye Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-[3-methyl-4-(p-tolyl)piperazin-1-yl]acetamide CAS Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[3-methyl-4-(4-methylphenyl)-1-piperazinyl]acetamide IUPAC Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]acetamide Traditional Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-[3-methyl-4-(p-tolyl)piperazino]acetamide Formula: C27H36N4OS MolecularWeight: 464.66594

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=C(C=C2)C)CC(=O)NC3=C(C4=C(S3)CC(CC4)C(C)(C)C)C#N

Isomeric SMILES

CC1CN(CCN1C2=CC=C(C=C2)C)CC(=O)NC3=C(C4=C(S3)CC(CC4)C(C)(C)C)C#N

InChI

InChI=1S/C27H36N4OS/c1-18-6-9-21(10-7-18)31-13-12-30(16-19(31)2)17-25(32)29-26-23(15-28)22-11-8-20(27(3,4)5)14-24(22)33-26/h6-7,9-10,19-20H,8,11-14,16-17H2,1-5H3,(H,29,32)