N-[2-[2-(methylamino)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]-2-methylsulfonyl-benzamide

Systemtic Name: N-[2-[2-(methylamino)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]-2-methylsulfonyl-benzamide Openeye Name: N-[2-[2-(methylamino)-2-oxo-ethyl]sulfanyl-4-phenyl-thiazol-5-yl]-2-methylsulfonyl-benzamide CAS Name: N-[2-[[2-(methylamino)-2-oxoethyl]thio]-4-phenyl-5-thiazolyl]-2-methylsulfonylbenzamide IUPAC Name: N-[2-[2-(methylamino)-2-oxoethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]-2-methylsulfonylbenzamide Traditional Name: N-[2-[[2-keto-2-(methylamino)ethyl]thio]-4-phenyl-thiazol-5-yl]-2-mesyl-benzamide Formula: C20H19N3O4S3 MolecularWeight: 461.57756

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CSC1=NC(=C(S1)NC(=O)C2=CC=CC=C2S(=O)(=O)C)C3=CC=CC=C3

Isomeric SMILES

CNC(=O)CSC1=NC(=C(S1)NC(=O)C2=CC=CC=C2S(=O)(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C20H19N3O4S3/c1-21-16(24)12-28-20-22-17(13-8-4-3-5-9-13)19(29-20)23-18(25)14-10-6-7-11-15(14)30(2,26)27/h3-11H,12H2,1-2H3,(H,21,24)(H,23,25)