N-aminocarbonyl-3-methyl-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-butanamide

Systemtic Name: N-aminocarbonyl-3-methyl-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-butanamide Openeye Name: N-carbamoyl-3-methyl-2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanyl]butanamide CAS Name: N-carbamoyl-3-methyl-2-[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]butanamide IUPAC Name: N-carbamoyl-3-methyl-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylbutanamide Traditional Name: N-carbamoyl-3-methyl-2-[(5-pyrrolidinosulfonyl-2-pyridyl)thio]butyramide Formula: C15H22N4O4S2 MolecularWeight: 386.48958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)SC1=NC=C(C=C1)S(=O)(=O)N2CCCC2

Isomeric SMILES

CC(C)C(C(=O)NC(=O)N)SC1=NC=C(C=C1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C15H22N4O4S2/c1-10(2)13(14(20)18-15(16)21)24-12-6-5-11(9-17-12)25(22,23)19-7-3-4-8-19/h5-6,9-10,13H,3-4,7-8H2,1-2H3,(H3,16,18,20,21)