4-[[5-[(2-cyanophenyl)diazenyl]-8-(methylsulfonylamino)naphthalen-2-yl]sulfonylamino]benzenesulfinic acid

Systemtic Name: 4-[[5-[(2-cyanophenyl)diazenyl]-8-(methylsulfonylamino)naphthalen-2-yl]sulfonylamino]benzenesulfinic acid Openeye Name: 4-[[5-(2-cyanophenyl)azo-8-(methanesulfonamido)-2-naphthyl]sulfonylamino]benzenesulfinic acid CAS Name: 4-[[5-(2-cyanophenyl)azo-8-(methanesulfonamido)-2-naphthalenyl]sulfonylamino]benzenesulfinic acid IUPAC Name: 4-[[5-[(2-cyanophenyl)diazenyl]-8-(methanesulfonamido)naphthalen-2-yl]sulfonylamino]benzenesulfinic acid Traditional Name: 4-[[5-(2-cyanophenyl)azo-8-(methanesulfonamido)-2-naphthyl]sulfonylamino]benzenesulfinic acid Formula: C24H19N5O6S3 MolecularWeight: 569.63256

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=C2C=C(C=CC2=C(C=C1)N=NC3=CC=CC=C3C#N)S(=O)(=O)NC4=CC=C(C=C4)S(=O)O

Isomeric SMILES

CS(=O)(=O)NC1=C2C=C(C=CC2=C(C=C1)N=NC3=CC=CC=C3C#N)S(=O)(=O)NC4=CC=C(C=C4)S(=O)O

InChI

InChI=1S/C24H19N5O6S3/c1-37(32,33)29-24-13-12-23(27-26-22-5-3-2-4-16(22)15-25)20-11-10-19(14-21(20)24)38(34,35)28-17-6-8-18(9-7-17)36(30)31/h2-14,28-29H,1H3,(H,30,31)