2-(1,3-benzothiazol-2-ylsulfonyl)-3-[(4-fluorophenyl)amino]prop-2-enenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfonyl)-3-[(4-fluorophenyl)amino]prop-2-enenitrile Openeye Name: 2-(1,3-benzothiazol-2-ylsulfonyl)-3-(4-fluoroanilino)prop-2-enenitrile CAS Name: 2-(1,3-benzothiazol-2-ylsulfonyl)-3-(4-fluoroanilino)-2-propenenitrile IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfonyl)-3-(4-fluoroanilino)prop-2-enenitrile Traditional Name: 2-(1,3-benzothiazol-2-ylsulfonyl)-3-(4-fluoroanilino)acrylonitrile Formula: C16H10FN3O2S2 MolecularWeight: 359.397903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)S(=O)(=O)C(=CNC3=CC=C(C=C3)F)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)S(=O)(=O)C(=CNC3=CC=C(C=C3)F)C#N

InChI

InChI=1S/C16H10FN3O2S2/c17-11-5-7-12(8-6-11)19-10-13(9-18)24(21,22)16-20-14-3-1-2-4-15(14)23-16/h1-8,10,19H