2-chloranyl-4-(2-dimethylaminoethylsulfanyl)-5-(2-oxidanylideneimidazolidin-1-yl)sulfonyl-benzenecarbonitrile

Systemtic Name: 2-chloranyl-4-(2-dimethylaminoethylsulfanyl)-5-(2-oxidanylideneimidazolidin-1-yl)sulfonyl-benzenecarbonitrile Openeye Name: 2-chloro-4-(2-dimethylaminoethylsulfanyl)-5-(2-oxoimidazolidin-1-yl)sulfonyl-benzonitrile CAS Name: 2-chloro-4-(2-dimethylaminoethylthio)-5-[(2-oxo-1-imidazolidinyl)sulfonyl]benzonitrile IUPAC Name: 2-chloro-4-(2-dimethylaminoethylsulfanyl)-5-(2-oxoimidazolidin-1-yl)sulfonylbenzonitrile Traditional Name: 2-chloro-4-(2-dimethylaminoethylthio)-5-(2-ketoimidazolidin-1-yl)sulfonyl-benzonitrile Formula: C14H17ClN4O3S2 MolecularWeight: 388.89278

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCSC1=C(C=C(C(=C1)Cl)C#N)S(=O)(=O)N2CCNC2=O

Isomeric SMILES

CN(C)CCSC1=C(C=C(C(=C1)Cl)C#N)S(=O)(=O)N2CCNC2=O

InChI

InChI=1S/C14H17ClN4O3S2/c1-18(2)5-6-23-12-8-11(15)10(9-16)7-13(12)24(21,22)19-4-3-17-14(19)20/h7-8H,3-6H2,1-2H3,(H,17,20)