4-[2-(6-butyl-3-cyano-pyridin-2-yl)sulfanylbutanoylamino]benzamide

Systemtic Name: 4-[2-(6-butyl-3-cyano-pyridin-2-yl)sulfanylbutanoylamino]benzamide Openeye Name: 4-[2-[(6-butyl-3-cyano-2-pyridyl)sulfanyl]butanoylamino]benzamide CAS Name: 4-[[2-[(6-butyl-3-cyano-2-pyridinyl)thio]-1-oxobutyl]amino]benzamide IUPAC Name: 4-[2-(6-butyl-3-cyanopyridin-2-yl)sulfanylbutanoylamino]benzamide Traditional Name: 4-[2-[(6-butyl-3-cyano-2-pyridyl)thio]butanoylamino]benzamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(C=C1)C#N)SC(CC)C(=O)NC2=CC=C(C=C2)C(=O)N

Isomeric SMILES

CCCCC1=NC(=C(C=C1)C#N)SC(CC)C(=O)NC2=CC=C(C=C2)C(=O)N

InChI

InChI=1S/C21H24N4O2S/c1-3-5-6-16-12-9-15(13-22)21(25-16)28-18(4-2)20(27)24-17-10-7-14(8-11-17)19(23)26/h7-12,18H,3-6H2,1-2H3,(H2,23,26)(H,24,27)