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

Systemtic Name: N,N'-bis(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanediamide Openeye Name: N,N'-bis(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)propanediamide CAS Name: N,N'-bis(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanediamide IUPAC Name: N,N'-bis(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanediamide Traditional Name: N,N'-bis(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)malonamide Formula: C23H24N4O2S2 MolecularWeight: 452.59226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24N4O2S2/c1-12-3-5-14-16(10-24)22(30-18(14)7-12)26-20(28)9-21(29)27-23-17(11-25)15-6-4-13(2)8-19(15)31-23/h12-13H,3-9H2,1-2H3,(H,26,28)(H,27,29)