2-[4-cyano-2-(2-oxidanylideneimidazolidin-1-yl)sulfonyl-phenyl]sulfanyl-N-[1-(dimethylamino)propan-2-yl]butanamide

Systemtic Name: 2-[4-cyano-2-(2-oxidanylideneimidazolidin-1-yl)sulfonyl-phenyl]sulfanyl-N-[1-(dimethylamino)propan-2-yl]butanamide Openeye Name: 2-[4-cyano-2-(2-oxoimidazolidin-1-yl)sulfonyl-phenyl]sulfanyl-N-[2-(dimethylamino)-1-methyl-ethyl]butanamide CAS Name: 2-[[4-cyano-2-[(2-oxo-1-imidazolidinyl)sulfonyl]phenyl]thio]-N-[1-(dimethylamino)propan-2-yl]butanamide IUPAC Name: 2-[4-cyano-2-(2-oxoimidazolidin-1-yl)sulfonylphenyl]sulfanyl-N-[1-(dimethylamino)propan-2-yl]butanamide Traditional Name: 2-[[4-cyano-2-(2-ketoimidazolidin-1-yl)sulfonyl-phenyl]thio]-N-[2-(dimethylamino)-1-methyl-ethyl]butyramide Formula: C19H27N5O4S2 MolecularWeight: 453.57878

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC(C)CN(C)C)SC1=C(C=C(C=C1)C#N)S(=O)(=O)N2CCNC2=O

Isomeric SMILES

CCC(C(=O)NC(C)CN(C)C)SC1=C(C=C(C=C1)C#N)S(=O)(=O)N2CCNC2=O

InChI

InChI=1S/C19H27N5O4S2/c1-5-15(18(25)22-13(2)12-23(3)4)29-16-7-6-14(11-20)10-17(16)30(27,28)24-9-8-21-19(24)26/h6-7,10,13,15H,5,8-9,12H2,1-4H3,(H,21,26)(H,22,25)