[4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] 3-methylquinoline-8-sulfonate

Systemtic Name: [4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] 3-methylquinoline-8-sulfonate Openeye Name: [4-[methyl(2-thienylsulfonyl)amino]phenyl] 3-methylquinoline-8-sulfonate CAS Name: 3-methyl-8-quinolinesulfonic acid [4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] ester IUPAC Name: [4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] 3-methylquinoline-8-sulfonate Traditional Name: 3-methylquinoline-8-sulfonic acid [4-[methyl(2-thienylsulfonyl)amino]phenyl] ester Formula: C21H18N2O5S3 MolecularWeight: 474.57302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)OC3=CC=C(C=C3)N(C)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)OC3=CC=C(C=C3)N(C)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H18N2O5S3/c1-15-13-16-5-3-6-19(21(16)22-14-15)31(26,27)28-18-10-8-17(9-11-18)23(2)30(24,25)20-7-4-12-29-20/h3-14H,1-2H3