(5-bromanyl-3-methoxy-pyrazin-2-yl)-(methylamino)-naphthalen-1-ylsulfonyl-phenylmethoxycarbonyl-azanium

Systemtic Name: (5-bromanyl-3-methoxy-pyrazin-2-yl)-(methylamino)-naphthalen-1-ylsulfonyl-phenylmethoxycarbonyl-azanium Openeye Name: benzyloxycarbonyl-(5-bromo-3-methoxy-pyrazin-2-yl)-(methylamino)-(1-naphthylsulfonyl)ammonium CAS Name: (5-bromo-3-methoxy-2-pyrazinyl)-(methylamino)-(1-naphthalenylsulfonyl)-phenylmethoxycarbonylammonium IUPAC Name: (5-bromo-3-methoxypyrazin-2-yl)-(methylamino)-naphthalen-1-ylsulfonyl-phenylmethoxycarbonylazanium Traditional Name: (5-bromo-3-methoxy-pyrazin-2-yl)-carbobenzoxy-(methylamino)-(1-naphthylsulfonyl)ammonium Formula: C24H22BrN4O5S+ MolecularWeight: 558.42428

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Descriptors Computed from Structure

Canonical SMILES:

CN[N+](C1=NC=C(N=C1OC)Br)(C(=O)OCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CN[N+](C1=NC=C(N=C1OC)Br)(C(=O)OCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H22BrN4O5S/c1-26-29(22-23(33-2)28-21(25)15-27-22,24(30)34-16-17-9-4-3-5-10-17)35(31,32)20-14-8-12-18-11-6-7-13-19(18)20/h3-15,26H,16H2,1-2H3/q+1