2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]ethanamide

Systemtic Name: 2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]ethanamide Openeye Name: 2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)sulfanyl]-N-[[4-(1-piperidylsulfonyl)phenyl]methyl]acetamide CAS Name: 2-[(3-cyano-4,5,6-trimethyl-2-pyridinyl)thio]-N-[[4-(1-piperidinylsulfonyl)phenyl]methyl]acetamide IUPAC Name: 2-(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]acetamide Traditional Name: 2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)thio]-N-(4-piperidinosulfonylbenzyl)acetamide Formula: C23H28N4O3S2 MolecularWeight: 472.62342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C#N)SCC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C#N)SCC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)C

InChI

InChI=1S/C23H28N4O3S2/c1-16-17(2)21(13-24)23(26-18(16)3)31-15-22(28)25-14-19-7-9-20(10-8-19)32(29,30)27-11-5-4-6-12-27/h7-10H,4-6,11-12,14-15H2,1-3H3,(H,25,28)