S-[2-[(4-sulfamoylphenyl)methylcarbamoyl]phenyl] 2-methoxybenzenecarbothioate

Systemtic Name: S-[2-[(4-sulfamoylphenyl)methylcarbamoyl]phenyl] 2-methoxybenzenecarbothioate Openeye Name: S-[2-[(4-sulfamoylphenyl)methylcarbamoyl]phenyl] 2-methoxybenzenecarbothioate CAS Name: 2-methoxybenzenecarbothioic acid S-[2-[oxo-[(4-sulfamoylphenyl)methylamino]methyl]phenyl] ester IUPAC Name: S-[2-[(4-sulfamoylphenyl)methylcarbamoyl]phenyl] 2-methoxybenzenecarbothioate Traditional Name: 2-methoxythiobenzoic acid S-[2-[(4-sulfamoylbenzyl)carbamoyl]phenyl] ester Formula: C22H20N2O5S2 MolecularWeight: 456.5346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)SC2=CC=CC=C2C(=O)NCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

COC1=CC=CC=C1C(=O)SC2=CC=CC=C2C(=O)NCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C22H20N2O5S2/c1-29-19-8-4-2-6-17(19)22(26)30-20-9-5-3-7-18(20)21(25)24-14-15-10-12-16(13-11-15)31(23,27)28/h2-13H,14H2,1H3,(H,24,25)(H2,23,27,28)