N2,N5-bis(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pyridine-2,5-dicarboxamide

Systemtic Name: N2,N5-bis(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pyridine-2,5-dicarboxamide Openeye Name: N2,N5-bis(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)pyridine-2,5-dicarboxamide CAS Name: N2,N5-bis(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pyridine-2,5-dicarboxamide IUPAC Name: 2-N,5-N-bis(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pyridine-2,5-dicarboxamide Traditional Name: N,N'-bis(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)isocinchomeronamide Formula: C29H29N5O2S2 MolecularWeight: 543.70286

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CN=C(C=C3)C(=O)NC4=C(C5=C(S4)CC(CC5)CC)C#N

Isomeric SMILES

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CN=C(C=C3)C(=O)NC4=C(C5=C(S4)CC(CC5)CC)C#N

InChI

InChI=1S/C29H29N5O2S2/c1-3-16-5-8-19-21(13-30)28(37-24(19)11-16)33-26(35)18-7-10-23(32-15-18)27(36)34-29-22(14-31)20-9-6-17(4-2)12-25(20)38-29/h7,10,15-17H,3-6,8-9,11-12H2,1-2H3,(H,33,35)(H,34,36)