N,N'-bis(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)hexanediamide

Systemtic Name: N,N'-bis(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)hexanediamide Openeye Name: N,N'-bis(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)hexanediamide CAS Name: N,N'-bis(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)hexanediamide IUPAC Name: N,N'-bis(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)hexanediamide Traditional Name: N,N'-bis(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)adipamide Formula: C32H42N4O2S2 MolecularWeight: 578.83148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)CCCCC(=O)NC3=C(C4=C(S3)CC(CC4)C(C)(C)C)C#N

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)CCCCC(=O)NC3=C(C4=C(S3)CC(CC4)C(C)(C)C)C#N

InChI

InChI=1S/C32H42N4O2S2/c1-31(2,3)19-11-13-21-23(17-33)29(39-25(21)15-19)35-27(37)9-7-8-10-28(38)36-30-24(18-34)22-14-12-20(32(4,5)6)16-26(22)40-30/h19-20H,7-16H2,1-6H3,(H,35,37)(H,36,38)