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

Systemtic Name: [4-[(2E)-3-ethyl-2-thiophen-2-ylsulfonylimino-1,3-thiazol-4-yl]phenyl] benzoate Openeye Name: [4-[(2E)-3-ethyl-2-(2-thienylsulfonylimino)thiazol-4-yl]phenyl] benzoate CAS Name: benzoic acid [4-[(2E)-3-ethyl-2-thiophen-2-ylsulfonylimino-4-thiazolyl]phenyl] ester IUPAC Name: [4-[(2E)-3-ethyl-2-thiophen-2-ylsulfonylimino-1,3-thiazol-4-yl]phenyl] benzoate Traditional Name: benzoic acid [4-[(2E)-3-ethyl-2-(2-thienylsulfonylimino)-4-thiazolin-4-yl]phenyl] ester Formula: C22H18N2O4S3 MolecularWeight: 470.58432

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CSC1=NS(=O)(=O)C2=CC=CS2)C3=CC=C(C=C3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CCN\1C(=CS/C1=N/S(=O)(=O)C2=CC=CS2)C3=CC=C(C=C3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H18N2O4S3/c1-2-24-19(15-30-22(24)23-31(26,27)20-9-6-14-29-20)16-10-12-18(13-11-16)28-21(25)17-7-4-3-5-8-17/h3-15H,2H2,1H3/b23-22+