N-(2-methylpropylcarbamoyl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(2-methylpropylcarbamoyl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-propanamide Openeye Name: N-(isobutylcarbamoyl)-2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]propanamide CAS Name: N-[(2-methylpropylamino)-oxomethyl]-2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]propanamide IUPAC Name: N-(2-methylpropylcarbamoyl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylpropanamide Traditional Name: N-(isobutylcarbamoyl)-2-[(5-piperidinosulfonyl-2-pyridyl)thio]propionamide Formula: C18H28N4O4S2 MolecularWeight: 428.56932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(=O)C(C)SC1=NC=C(C=C1)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CC(C)CNC(=O)NC(=O)C(C)SC1=NC=C(C=C1)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C18H28N4O4S2/c1-13(2)11-20-18(24)21-17(23)14(3)27-16-8-7-15(12-19-16)28(25,26)22-9-5-4-6-10-22/h7-8,12-14H,4-6,9-11H2,1-3H3,(H2,20,21,23,24)