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

Systemtic Name: N,N'-bis(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pentanediamide Openeye Name: N,N'-bis(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)pentanediamide CAS Name: N,N'-bis(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pentanediamide IUPAC Name: N,N'-bis(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pentanediamide Traditional Name: N,N'-bis(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)glutaramide Formula: C31H40N4O2S2 MolecularWeight: 564.8049

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C31H40N4O2S2/c1-30(2,3)18-10-12-20-22(16-32)28(38-24(20)14-18)34-26(36)8-7-9-27(37)35-29-23(17-33)21-13-11-19(31(4,5)6)15-25(21)39-29/h18-19H,7-15H2,1-6H3,(H,34,36)(H,35,37)