4-[2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylpropanoylamino]-N-(4-ethoxyphenyl)benzamide

Systemtic Name: 4-[2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylpropanoylamino]-N-(4-ethoxyphenyl)benzamide Openeye Name: 4-[2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]propanoylamino]-N-(4-ethoxyphenyl)benzamide CAS Name: 4-[[2-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]-1-oxopropyl]amino]-N-(4-ethoxyphenyl)benzamide IUPAC Name: 4-[2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylpropanoylamino]-N-(4-ethoxyphenyl)benzamide Traditional Name: 4-[2-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]propanoylamino]-N-p-phenetyl-benzamide Formula: C26H26N4O3S MolecularWeight: 474.57464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C(C)SC3=C(C(=CC(=N3)C)C)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C(C)SC3=C(C(=CC(=N3)C)C)C#N

InChI

InChI=1S/C26H26N4O3S/c1-5-33-22-12-10-21(11-13-22)30-25(32)19-6-8-20(9-7-19)29-24(31)18(4)34-26-23(15-27)16(2)14-17(3)28-26/h6-14,18H,5H2,1-4H3,(H,29,31)(H,30,32)