N-[4-[bis(azanyl)methylideneamino]sulfonylphenyl]-2-(2-methyl-4,6-diphenyl-pyridin-1-ium-1-yl)ethanamide

Systemtic Name: N-[4-[bis(azanyl)methylideneamino]sulfonylphenyl]-2-(2-methyl-4,6-diphenyl-pyridin-1-ium-1-yl)ethanamide Openeye Name: N-(4-guanidinosulfonylphenyl)-2-(2-methyl-4,6-diphenyl-pyridin-1-ium-1-yl)acetamide CAS Name: N-[4-(diaminomethylideneamino)sulfonylphenyl]-2-(2-methyl-4,6-diphenyl-1-pyridin-1-iumyl)acetamide IUPAC Name: N-[4-(diaminomethylideneamino)sulfonylphenyl]-2-(2-methyl-4,6-diphenylpyridin-1-ium-1-yl)acetamide Traditional Name: N-(4-guanidinosulfonylphenyl)-2-(2-methyl-4,6-diphenyl-pyridin-1-ium-1-yl)acetamide Formula: C27H26N5O3S+ MolecularWeight: 500.59204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=[N+]1CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC(=[N+]1CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H25N5O3S/c1-19-16-22(20-8-4-2-5-9-20)17-25(21-10-6-3-7-11-21)32(19)18-26(33)30-23-12-14-24(15-13-23)36(34,35)31-27(28)29/h2-17H,18H2,1H3,(H4-,28,29,30,31,33)/p+1