[4-[(4-methylphenyl)carbonyl-thiophen-2-ylsulfonyl-amino]phenyl] 4-methylbenzoate

Systemtic Name: [4-[(4-methylphenyl)carbonyl-thiophen-2-ylsulfonyl-amino]phenyl] 4-methylbenzoate Openeye Name: [4-[(4-methylbenzoyl)-(2-thienylsulfonyl)amino]phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-[[(4-methylphenyl)-oxomethyl]-thiophen-2-ylsulfonylamino]phenyl] ester IUPAC Name: [4-[(4-methylbenzoyl)-thiophen-2-ylsulfonylamino]phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-[p-toluoyl(2-thienylsulfonyl)amino]phenyl] ester Formula: C26H21NO5S2 MolecularWeight: 491.57864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C26H21NO5S2/c1-18-5-9-20(10-6-18)25(28)27(34(30,31)24-4-3-17-33-24)22-13-15-23(16-14-22)32-26(29)21-11-7-19(2)8-12-21/h3-17H,1-2H3