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

Systemtic Name: N,N'-bis(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pentanediamide Openeye Name: N,N'-bis(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)pentanediamide CAS Name: N,N'-bis(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pentanediamide IUPAC Name: N,N'-bis(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pentanediamide Traditional Name: N,N'-bis(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)glutaramide Formula: C25H28N4O2S2 MolecularWeight: 480.64542

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)CCCC(=O)NC3=C(C4=C(S3)CC(CC4)C)C#N

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)CCCC(=O)NC3=C(C4=C(S3)CC(CC4)C)C#N

InChI

InChI=1S/C25H28N4O2S2/c1-14-6-8-16-18(12-26)24(32-20(16)10-14)28-22(30)4-3-5-23(31)29-25-19(13-27)17-9-7-15(2)11-21(17)33-25/h14-15H,3-11H2,1-2H3,(H,28,30)(H,29,31)