N1,N3-bis(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzene-1,3-dicarboxamide

Systemtic Name: N1,N3-bis(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)benzene-1,3-dicarboxamide CAS Name: N1,N3-bis(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzene-1,3-dicarboxamide Traditional Name: N,N'-bis(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)isophthalamide Formula: C26H22N4O2S2 MolecularWeight: 486.60848

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=CC=C3)C(=O)NC4=C(C5=C(S4)CCCC5)C#N)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=CC=C3)C(=O)NC4=C(C5=C(S4)CCCC5)C#N)C#N

InChI

InChI=1S/C26H22N4O2S2/c27-13-19-17-8-1-3-10-21(17)33-25(19)29-23(31)15-6-5-7-16(12-15)24(32)30-26-20(14-28)18-9-2-4-11-22(18)34-26/h5-7,12H,1-4,8-11H2,(H,29,31)(H,30,32)