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

Systemtic Name: [4-[3-[(E)-but-2-enyl]-2-thiophen-2-ylsulfonylimino-1,3-thiazol-4-yl]phenyl] benzoate Openeye Name: [4-[3-[(E)-but-2-enyl]-2-(2-thienylsulfonylimino)thiazol-4-yl]phenyl] benzoate CAS Name: benzoic acid [4-[3-[(E)-but-2-enyl]-2-thiophen-2-ylsulfonylimino-4-thiazolyl]phenyl] ester IUPAC Name: [4-[3-[(E)-but-2-enyl]-2-thiophen-2-ylsulfonylimino-1,3-thiazol-4-yl]phenyl] benzoate Traditional Name: benzoic acid [4-[3-[(E)-but-2-enyl]-2-(2-thienylsulfonylimino)-4-thiazolin-4-yl]phenyl] ester Formula: C24H20N2O4S3 MolecularWeight: 496.6216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C=C/CN1C(=CSC1=NS(=O)(=O)C2=CC=CS2)C3=CC=C(C=C3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H20N2O4S3/c1-2-3-15-26-21(17-32-24(26)25-33(28,29)22-10-7-16-31-22)18-11-13-20(14-12-18)30-23(27)19-8-5-4-6-9-19/h2-14,16-17H,15H2,1H3/b3-2+,25-24?