4-[2-[4-(dimethylamino)but-2-ynylsulfanyl]-5-nitro-benzimidazol-1-yl]-N,N-dimethyl-but-2-yn-1-amine

Systemtic Name: 4-[2-[4-(dimethylamino)but-2-ynylsulfanyl]-5-nitro-benzimidazol-1-yl]-N,N-dimethyl-but-2-yn-1-amine Openeye Name: 4-[2-[4-(dimethylamino)but-2-ynylsulfanyl]-5-nitro-benzimidazol-1-yl]-N,N-dimethyl-but-2-yn-1-amine CAS Name: 4-[2-[4-(dimethylamino)but-2-ynylthio]-5-nitro-1-benzimidazolyl]-N,N-dimethyl-2-butyn-1-amine IUPAC Name: 4-[2-[4-(dimethylamino)but-2-ynylsulfanyl]-5-nitrobenzimidazol-1-yl]-N,N-dimethylbut-2-yn-1-amine Traditional Name: 4-[[1-[4-(dimethylamino)but-2-ynyl]-5-nitro-benzimidazol-2-yl]thio]but-2-ynyl-dimethyl-amine Formula: C19H23N5O2S MolecularWeight: 385.48322

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC#CCN1C2=C(C=C(C=C2)[N+](=O)[O-])N=C1SCC#CCN(C)C

Isomeric SMILES

CN(C)CC#CCN1C2=C(C=C(C=C2)[N+](=O)[O-])N=C1SCC#CCN(C)C

InChI

InChI=1S/C19H23N5O2S/c1-21(2)11-5-6-13-23-18-10-9-16(24(25)26)15-17(18)20-19(23)27-14-8-7-12-22(3)4/h9-10,15H,11-14H2,1-4H3