N2,N6-bis(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pyridine-2,6-dicarboxamide

Systemtic Name: N2,N6-bis(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pyridine-2,6-dicarboxamide Openeye Name: N2,N6-bis(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)pyridine-2,6-dicarboxamide CAS Name: N2,N6-bis(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pyridine-2,6-dicarboxamide IUPAC Name: 2-N,6-N-bis(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pyridine-2,6-dicarboxamide Traditional Name: N,N'-bis(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)dipicolinamide Formula: C29H29N5O2S2 MolecularWeight: 543.70286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H29N5O2S2/c1-3-16-8-10-18-20(14-30)28(37-24(18)12-16)33-26(35)22-6-5-7-23(32-22)27(36)34-29-21(15-31)19-11-9-17(4-2)13-25(19)38-29/h5-7,16-17H,3-4,8-13H2,1-2H3,(H,33,35)(H,34,36)