S-phenoxy N-[4-[formamido-(4-methylphenyl)sulfonyl-amino]phenyl]carbamothioate

Systemtic Name: S-phenoxy N-[4-[formamido-(4-methylphenyl)sulfonyl-amino]phenyl]carbamothioate Openeye Name: S-phenoxy N-[4-[formamido(p-tolylsulfonyl)amino]phenyl]carbamothioate CAS Name: [4-[formamido-(4-methylphenyl)sulfonylamino]anilino]-oxomethanesulfenic acid phenyl ester IUPAC Name: S-phenoxy N-[4-[formamido-(4-methylphenyl)sulfonylamino]phenyl]carbamothioate Traditional Name: N-[4-[formamido(tosyl)amino]phenyl]thiocarbamic acid S-phenoxy ester Formula: C21H19N3O5S2 MolecularWeight: 457.52266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C2=CC=C(C=C2)NC(=O)SOC3=CC=CC=C3)NC=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C2=CC=C(C=C2)NC(=O)SOC3=CC=CC=C3)NC=O

InChI

InChI=1S/C21H19N3O5S2/c1-16-7-13-20(14-8-16)31(27,28)24(22-15-25)18-11-9-17(10-12-18)23-21(26)30-29-19-5-3-2-4-6-19/h2-15H,1H3,(H,22,25)(H,23,26)