(2S)-N-[6-(dimethylamino)pyridin-3-yl]-3-methyl-2-(thiophen-2-ylsulfonylamino)butanamide

Systemtic Name: (2S)-N-[6-(dimethylamino)pyridin-3-yl]-3-methyl-2-(thiophen-2-ylsulfonylamino)butanamide Openeye Name: (2S)-N-[6-(dimethylamino)-3-pyridyl]-3-methyl-2-(2-thienylsulfonylamino)butanamide CAS Name: (2S)-N-[6-(dimethylamino)-3-pyridinyl]-3-methyl-2-(thiophen-2-ylsulfonylamino)butanamide IUPAC Name: (2S)-N-[6-(dimethylamino)pyridin-3-yl]-3-methyl-2-(thiophen-2-ylsulfonylamino)butanamide Traditional Name: (2S)-N-[6-(dimethylamino)-3-pyridyl]-3-methyl-2-(2-thienylsulfonylamino)butyramide Formula: C16H22N4O3S2 MolecularWeight: 382.50088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CN=C(C=C1)N(C)C)NS(=O)(=O)C2=CC=CS2

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CN=C(C=C1)N(C)C)NS(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C16H22N4O3S2/c1-11(2)15(19-25(22,23)14-6-5-9-24-14)16(21)18-12-7-8-13(17-10-12)20(3)4/h5-11,15,19H,1-4H3,(H,18,21)/t15-/m0/s1