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

Systemtic Name: (2R)-N-(cyclopropylcarbamoyl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-(cyclopropylcarbamoyl)-2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]propanamide CAS Name: (2R)-N-[(cyclopropylamino)-oxomethyl]-2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]propanamide IUPAC Name: (2R)-N-(cyclopropylcarbamoyl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-(cyclopropylcarbamoyl)-2-[(5-piperidinosulfonyl-2-pyridyl)thio]propionamide Formula: C17H24N4O4S2 MolecularWeight: 412.52686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1CC1)SC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC1CC1)SC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C17H24N4O4S2/c1-12(16(22)20-17(23)19-13-5-6-13)26-15-8-7-14(11-18-15)27(24,25)21-9-3-2-4-10-21/h7-8,11-13H,2-6,9-10H2,1H3,(H2,19,20,22,23)/t12-/m1/s1