1-[5-tert-butyl-2-methoxy-3-(methylsulfonylamino)phenyl]-3-[4-(3,5-dimethylpyrazin-1-ium-1-yl)oxynaphthalen-1-yl]urea

Systemtic Name: 1-[5-tert-butyl-2-methoxy-3-(methylsulfonylamino)phenyl]-3-[4-(3,5-dimethylpyrazin-1-ium-1-yl)oxynaphthalen-1-yl]urea Openeye Name: 1-[5-tert-butyl-3-(methanesulfonamido)-2-methoxy-phenyl]-3-[4-(3,5-dimethylpyrazin-1-ium-1-yl)oxy-1-naphthyl]urea CAS Name: 1-[5-tert-butyl-3-(methanesulfonamido)-2-methoxyphenyl]-3-[4-[(3,5-dimethyl-1-pyrazin-1-iumyl)oxy]-1-naphthalenyl]urea IUPAC Name: 1-[5-tert-butyl-3-(methanesulfonamido)-2-methoxyphenyl]-3-[4-(3,5-dimethylpyrazin-1-ium-1-yl)oxynaphthalen-1-yl]urea Traditional Name: 1-[5-tert-butyl-3-(methanesulfonamido)-2-methoxy-phenyl]-3-[4-(3,5-dimethylpyrazin-1-ium-1-yl)oxy-1-naphthyl]urea Formula: C29H34N5O5S+ MolecularWeight: 564.67576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CC(=N1)C)OC2=CC=C(C3=CC=CC=C32)NC(=O)NC4=C(C(=CC(=C4)C(C)(C)C)NS(=O)(=O)C)OC

Isomeric SMILES

CC1=C[N+](=CC(=N1)C)OC2=CC=C(C3=CC=CC=C32)NC(=O)NC4=C(C(=CC(=C4)C(C)(C)C)NS(=O)(=O)C)OC

InChI

InChI=1S/C29H33N5O5S/c1-18-16-34(17-19(2)30-18)39-26-13-12-23(21-10-8-9-11-22(21)26)31-28(35)32-24-14-20(29(3,4)5)15-25(27(24)38-6)33-40(7,36)37/h8-17,33H,1-7H3,(H-,31,32,35)/p+1