3-[2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanylethanoylamino]-N-ethyl-benzamide

Systemtic Name: 3-[2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanylethanoylamino]-N-ethyl-benzamide Openeye Name: 3-[[2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)sulfanyl]acetyl]amino]-N-ethyl-benzamide CAS Name: 3-[[2-[(3-cyano-4,5,6-trimethyl-2-pyridinyl)thio]-1-oxoethyl]amino]-N-ethylbenzamide IUPAC Name: 3-[[2-(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanylacetyl]amino]-N-ethylbenzamide Traditional Name: 3-[[2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)thio]acetyl]amino]-N-ethyl-benzamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC(=C(C(=C2C#N)C)C)C

Isomeric SMILES

CCNC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC(=C(C(=C2C#N)C)C)C

InChI

InChI=1S/C20H22N4O2S/c1-5-22-19(26)15-7-6-8-16(9-15)24-18(25)11-27-20-17(10-21)13(3)12(2)14(4)23-20/h6-9H,5,11H2,1-4H3,(H,22,26)(H,24,25)