(2R)-N-(4-acetamidophenyl)-2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(4-acetamidophenyl)-2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-(4-acetamidophenyl)-2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)sulfanyl]propanamide CAS Name: (2R)-N-(4-acetamidophenyl)-2-[(3-cyano-4,5,6-trimethyl-2-pyridinyl)thio]propanamide IUPAC Name: (2R)-N-(4-acetamidophenyl)-2-(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-(4-acetamidophenyl)-2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)thio]propionamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C#N)SC(C)C(=O)NC2=CC=C(C=C2)NC(=O)C)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C#N)S[C@H](C)C(=O)NC2=CC=C(C=C2)NC(=O)C)C

InChI

InChI=1S/C20H22N4O2S/c1-11-12(2)18(10-21)20(22-13(11)3)27-14(4)19(26)24-17-8-6-16(7-9-17)23-15(5)25/h6-9,14H,1-5H3,(H,23,25)(H,24,26)/t14-/m1/s1