N-butyl-2-[3-cyano-4,6-bis(4-methoxyphenyl)pyridin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-butyl-2-[3-cyano-4,6-bis(4-methoxyphenyl)pyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-butyl-2-[[3-cyano-4,6-bis(4-methoxyphenyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-butyl-2-[[3-cyano-4,6-bis(4-methoxyphenyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-butyl-2-[3-cyano-4,6-bis(4-methoxyphenyl)pyridin-2-yl]sulfanylacetamide Traditional Name: N-butyl-2-[[3-cyano-4,6-bis(4-methoxyphenyl)-2-pyridyl]thio]acetamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CSC1=C(C(=CC(=N1)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)C#N

Isomeric SMILES

CCCCNC(=O)CSC1=C(C(=CC(=N1)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)C#N

InChI

InChI=1S/C26H27N3O3S/c1-4-5-14-28-25(30)17-33-26-23(16-27)22(18-6-10-20(31-2)11-7-18)15-24(29-26)19-8-12-21(32-3)13-9-19/h6-13,15H,4-5,14,17H2,1-3H3,(H,28,30)