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

Systemtic Name: (2S)-2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-N-(2-methylpropylcarbamoyl)propanamide Openeye Name: (2S)-2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)sulfanyl]-N-(isobutylcarbamoyl)propanamide CAS Name: (2S)-2-[(3-cyano-4,5,6-trimethyl-2-pyridinyl)thio]-N-[(2-methylpropylamino)-oxomethyl]propanamide IUPAC Name: (2S)-2-(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanyl-N-(2-methylpropylcarbamoyl)propanamide Traditional Name: (2S)-2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)thio]-N-(isobutylcarbamoyl)propionamide Formula: C17H24N4O2S MolecularWeight: 348.46306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C#N)SC(C)C(=O)NC(=O)NCC(C)C)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C#N)S[C@@H](C)C(=O)NC(=O)NCC(C)C)C

InChI

InChI=1S/C17H24N4O2S/c1-9(2)8-19-17(23)21-15(22)13(6)24-16-14(7-18)11(4)10(3)12(5)20-16/h9,13H,8H2,1-6H3,(H2,19,21,22,23)/t13-/m0/s1