N-[(2S)-6-methylheptan-2-yl]-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(2S)-6-methylheptan-2-yl]-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-[(1S)-1,5-dimethylhexyl]-2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-[(2S)-6-methylheptan-2-yl]-2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-[(2S)-6-methylheptan-2-yl]-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylacetamide Traditional Name: N-[(1S)-1,5-dimethylhexyl]-2-[(5-piperidinosulfonyl-2-pyridyl)thio]acetamide Formula: C20H33N3O3S2 MolecularWeight: 427.62432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NC(=O)CSC1=NC=C(C=C1)S(=O)(=O)N2CCCCC2

Isomeric SMILES

C[C@@H](CCCC(C)C)NC(=O)CSC1=NC=C(C=C1)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C20H33N3O3S2/c1-16(2)8-7-9-17(3)22-19(24)15-27-20-11-10-18(14-21-20)28(25,26)23-12-5-4-6-13-23/h10-11,14,16-17H,4-9,12-13,15H2,1-3H3,(H,22,24)/t17-/m0/s1