(E)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-phenyl-N-(2-thiophen-2-ylethyl)prop-2-enamide

Systemtic Name: (E)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-phenyl-N-(2-thiophen-2-ylethyl)prop-2-enamide Openeye Name: (E)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-phenyl-N-[2-(2-thienyl)ethyl]prop-2-enamide CAS Name: (E)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-phenyl-N-(2-thiophen-2-ylethyl)-2-propenamide IUPAC Name: (E)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-phenyl-N-(2-thiophen-2-ylethyl)prop-2-enamide Traditional Name: (E)-N-(6-mesyl-1,3-benzothiazol-2-yl)-3-phenyl-N-[2-(2-thienyl)ethyl]acrylamide Formula: C23H20N2O3S3 MolecularWeight: 468.6115

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)N(CCC3=CC=CS3)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)N(CCC3=CC=CS3)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C23H20N2O3S3/c1-31(27,28)19-10-11-20-21(16-19)30-23(24-20)25(14-13-18-8-5-15-29-18)22(26)12-9-17-6-3-2-4-7-17/h2-12,15-16H,13-14H2,1H3/b12-9+