[4-[(2E)-3-ethyl-2-(4-ethylphenyl)sulfonylimino-1,3-thiazol-4-yl]phenyl] benzoate

Systemtic Name: [4-[(2E)-3-ethyl-2-(4-ethylphenyl)sulfonylimino-1,3-thiazol-4-yl]phenyl] benzoate Openeye Name: [4-[(2E)-3-ethyl-2-(4-ethylphenyl)sulfonylimino-thiazol-4-yl]phenyl] benzoate CAS Name: benzoic acid [4-[(2E)-3-ethyl-2-(4-ethylphenyl)sulfonylimino-4-thiazolyl]phenyl] ester IUPAC Name: [4-[(2E)-3-ethyl-2-(4-ethylphenyl)sulfonylimino-1,3-thiazol-4-yl]phenyl] benzoate Traditional Name: benzoic acid [4-[(2E)-3-ethyl-2-(4-ethylphenyl)sulfonylimino-4-thiazolin-4-yl]phenyl] ester Formula: C26H24N2O4S2 MolecularWeight: 492.60976

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)N=C2N(C(=CS2)C3=CC=C(C=C3)OC(=O)C4=CC=CC=C4)CC

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)/N=C/2\N(C(=CS2)C3=CC=C(C=C3)OC(=O)C4=CC=CC=C4)CC

InChI

InChI=1S/C26H24N2O4S2/c1-3-19-10-16-23(17-11-19)34(30,31)27-26-28(4-2)24(18-33-26)20-12-14-22(15-13-20)32-25(29)21-8-6-5-7-9-21/h5-18H,3-4H2,1-2H3/b27-26+