N2,N6-bis(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)pyridine-2,6-dicarboxamide

Systemtic Name: N2,N6-bis(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)pyridine-2,6-dicarboxamide Openeye Name: N2,N6-bis(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)pyridine-2,6-dicarboxamide CAS Name: N2,N6-bis(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)pyridine-2,6-dicarboxamide IUPAC Name: 2-N,6-N-bis(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)pyridine-2,6-dicarboxamide Traditional Name: N,N'-bis(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)dipicolinamide Formula: C27H25N5O2S2 MolecularWeight: 515.6497

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H25N5O2S2/c28-14-18-16-8-3-1-5-12-22(16)35-26(18)31-24(33)20-10-7-11-21(30-20)25(34)32-27-19(15-29)17-9-4-2-6-13-23(17)36-27/h7,10-11H,1-6,8-9,12-13H2,(H,31,33)(H,32,34)