1-[2-[2-azanylidene-3-(phenylmethyl)benzimidazol-1-yl]-3,3-dimethyl-2H-1-benzofuran-7-yl]-N-methyl-2-oxidanylidene-propane-1-sulfonamide hydrobromide

Systemtic Name: 1-[2-[2-azanylidene-3-(phenylmethyl)benzimidazol-1-yl]-3,3-dimethyl-2H-1-benzofuran-7-yl]-N-methyl-2-oxidanylidene-propane-1-sulfonamide hydrobromide Openeye Name: 1-[2-(3-benzyl-2-imino-benzimidazol-1-yl)-3,3-dimethyl-2H-benzofuran-7-yl]-N-methyl-2-oxo-propane-1-sulfonamide hydrobromide CAS Name: 1-[2-[2-imino-3-(phenylmethyl)-1-benzimidazolyl]-3,3-dimethyl-2H-benzofuran-7-yl]-N-methyl-2-oxo-1-propanesulfonamide hydrobromide IUPAC Name: 1-[2-(3-benzyl-2-iminobenzimidazol-1-yl)-3,3-dimethyl-2H-1-benzofuran-7-yl]-N-methyl-2-oxopropane-1-sulfonamide hydrobromide Traditional Name: 1-[2-(3-benzyl-2-imino-benzimidazol-1-yl)-3,3-dimethyl-coumaran-7-yl]-2-keto-N-methyl-propane-1-sulfonamide hydrobromide Formula: C28H31BrN4O4S MolecularWeight: 599.53914

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C1=CC=CC2=C1OC(C2(C)C)N3C4=CC=CC=C4N(C3=N)CC5=CC=CC=C5)S(=O)(=O)NC.Br

Isomeric SMILES

CC(=O)C(C1=CC=CC2=C1OC(C2(C)C)N3C4=CC=CC=C4N(C3=N)CC5=CC=CC=C5)S(=O)(=O)NC.Br

InChI

InChI=1S/C28H30N4O4S.BrH/c1-18(33)25(37(34,35)30-4)20-13-10-14-21-24(20)36-26(28(21,2)3)32-23-16-9-8-15-22(23)31(27(32)29)17-19-11-6-5-7-12-19;/h5-16,25-26,29-30H,17H2,1-4H3;1H