6-[(3S)-3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxidanylidene-propyl]sulfanyl-N,N-diethyl-pyridine-3-sulfonamide

Systemtic Name: 6-[(3S)-3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxidanylidene-propyl]sulfanyl-N,N-diethyl-pyridine-3-sulfonamide Openeye Name: 6-[(3S)-3-cyano-3-(4-methylthiazol-2-yl)-2-oxo-propyl]sulfanyl-N,N-diethyl-pyridine-3-sulfonamide CAS Name: 6-[[(3S)-3-cyano-3-(4-methyl-2-thiazolyl)-2-oxopropyl]thio]-N,N-diethyl-3-pyridinesulfonamide IUPAC Name: 6-[(3S)-3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxopropyl]sulfanyl-N,N-diethylpyridine-3-sulfonamide Traditional Name: 6-[[(3S)-3-cyano-2-keto-3-(4-methylthiazol-2-yl)propyl]thio]-N,N-diethyl-pyridine-3-sulfonamide Formula: C17H20N4O3S3 MolecularWeight: 424.5607

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CN=C(C=C1)SCC(=O)C(C#N)C2=NC(=CS2)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CN=C(C=C1)SCC(=O)[C@H](C#N)C2=NC(=CS2)C

InChI

InChI=1S/C17H20N4O3S3/c1-4-21(5-2)27(23,24)13-6-7-16(19-9-13)25-11-15(22)14(8-18)17-20-12(3)10-26-17/h6-7,9-10,14H,4-5,11H2,1-3H3/t14-/m0/s1