4-[bis(2-cyanoethyl)sulfamoyl]-N-(4-fluoranyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)benzamide

Systemtic Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-(4-fluoranyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)benzamide Openeye Name: N-(3-allyl-4-fluoro-1,3-benzothiazol-2-ylidene)-4-[bis(2-cyanoethyl)sulfamoyl]benzamide CAS Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-(4-fluoro-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)benzamide IUPAC Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-(4-fluoro-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)benzamide Traditional Name: N-(3-allyl-4-fluoro-1,3-benzothiazol-2-ylidene)-4-[bis(2-cyanoethyl)sulfamoyl]benzamide Formula: C23H20FN5O3S2 MolecularWeight: 497.565003

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(C=CC=C2SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(CCC#N)CCC#N)F

Isomeric SMILES

C=CCN1C2=C(C=CC=C2SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(CCC#N)CCC#N)F

InChI

InChI=1S/C23H20FN5O3S2/c1-2-14-29-21-19(24)6-3-7-20(21)33-23(29)27-22(30)17-8-10-18(11-9-17)34(31,32)28(15-4-12-25)16-5-13-26/h2-3,6-11H,1,4-5,14-16H2