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

Systemtic Name: N-[4-[bis(azanyl)methylideneamino]sulfonylphenyl]-2-(2,4-diphenyl-6-propan-2-yl-pyridin-1-ium-1-yl)ethanamide Openeye Name: N-(4-guanidinosulfonylphenyl)-2-(2-isopropyl-4,6-diphenyl-pyridin-1-ium-1-yl)acetamide CAS Name: N-[4-(diaminomethylideneamino)sulfonylphenyl]-2-(2,4-diphenyl-6-propan-2-yl-1-pyridin-1-iumyl)acetamide IUPAC Name: N-[4-(diaminomethylideneamino)sulfonylphenyl]-2-(2,4-diphenyl-6-propan-2-ylpyridin-1-ium-1-yl)acetamide Traditional Name: N-(4-guanidinosulfonylphenyl)-2-(2-isopropyl-4,6-diphenyl-pyridin-1-ium-1-yl)acetamide Formula: C29H30N5O3S+ MolecularWeight: 528.6452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=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

CC(C)C1=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/C29H29N5O3S/c1-20(2)26-17-23(21-9-5-3-6-10-21)18-27(22-11-7-4-8-12-22)34(26)19-28(35)32-24-13-15-25(16-14-24)38(36,37)33-29(30)31/h3-18,20H,19H2,1-2H3,(H4-,30,31,32,33,35)/p+1