N1,N2-bis(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)benzene-1,2-dicarboxamide

Systemtic Name: N1,N2-bis(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)benzene-1,2-dicarboxamide Openeye Name: N1,N2-bis(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)phthalamide CAS Name: N1,N2-bis(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)benzene-1,2-dicarboxamide IUPAC Name: 1-N,2-N-bis(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)benzene-1,2-dicarboxamide Traditional Name: N,N'-bis(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)phthalamide Formula: C28H26N4O2S2 MolecularWeight: 514.66164

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2C#N)NC(=O)C3=CC=CC=C3C(=O)NC4=C(C5=C(S4)CCCCC5)C#N

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2C#N)NC(=O)C3=CC=CC=C3C(=O)NC4=C(C5=C(S4)CCCCC5)C#N

InChI

InChI=1S/C28H26N4O2S2/c29-15-21-17-9-3-1-5-13-23(17)35-27(21)31-25(33)19-11-7-8-12-20(19)26(34)32-28-22(16-30)18-10-4-2-6-14-24(18)36-28/h7-8,11-12H,1-6,9-10,13-14H2,(H,31,33)(H,32,34)