N-[[4-(diethylamino)phenyl]methylideneamino]-2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[[4-(diethylamino)phenyl]methylideneamino]-2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanamide Openeye Name: N-[[4-(diethylamino)phenyl]methyleneamino]-2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide CAS Name: N-[[4-(diethylamino)phenyl]methylideneamino]-2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)thio]acetamide IUPAC Name: N-[[4-(diethylamino)phenyl]methylideneamino]-2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide Traditional Name: N-[[4-(diethylamino)benzylidene]amino]-2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)thio]acetamide Formula: C22H28N5OS+ MolecularWeight: 410.55562

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(NC2=CC=CC=C21)SCC(=O)NN=CC3=CC=C(C=C3)N(CC)CC

Isomeric SMILES

CC[N+]1=C(NC2=CC=CC=C21)SCC(=O)NN=CC3=CC=C(C=C3)N(CC)CC

InChI

InChI=1S/C22H27N5OS/c1-4-26(5-2)18-13-11-17(12-14-18)15-23-25-21(28)16-29-22-24-19-9-7-8-10-20(19)27(22)6-3/h7-15H,4-6,16H2,1-3H3,(H,25,28)/p+1