2-(6-azanyl-3,5-dicyano-pyridin-2-yl)sulfanyl-N-[(2R)-5-methylhexan-2-yl]ethanamide

Systemtic Name: 2-(6-azanyl-3,5-dicyano-pyridin-2-yl)sulfanyl-N-[(2R)-5-methylhexan-2-yl]ethanamide Openeye Name: 2-[(6-amino-3,5-dicyano-2-pyridyl)sulfanyl]-N-[(1R)-1,4-dimethylpentyl]acetamide CAS Name: 2-[(6-amino-3,5-dicyano-2-pyridinyl)thio]-N-[(2R)-5-methylhexan-2-yl]acetamide IUPAC Name: 2-(6-amino-3,5-dicyanopyridin-2-yl)sulfanyl-N-[(2R)-5-methylhexan-2-yl]acetamide Traditional Name: 2-[(6-amino-3,5-dicyano-2-pyridyl)thio]-N-[(1R)-1,4-dimethylpentyl]acetamide Formula: C16H21N5OS MolecularWeight: 331.43584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC(=O)CSC1=C(C=C(C(=N1)N)C#N)C#N

Isomeric SMILES

C[C@H](CCC(C)C)NC(=O)CSC1=C(C=C(C(=N1)N)C#N)C#N

InChI

InChI=1S/C16H21N5OS/c1-10(2)4-5-11(3)20-14(22)9-23-16-13(8-18)6-12(7-17)15(19)21-16/h6,10-11H,4-5,9H2,1-3H3,(H2,19,21)(H,20,22)/t11-/m1/s1