(E)-N-(2-dimethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-(2-dimethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-(2-dimethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-(2-dimethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-(2-dimethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-(2-dimethylaminoethyl)-N-(4-mesyl-1,3-benzothiazol-2-yl)-3-(2-thienyl)acrylamide Formula: C19H21N3O3S3 MolecularWeight: 435.58334

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C1=NC2=C(S1)C=CC=C2S(=O)(=O)C)C(=O)C=CC3=CC=CS3

Isomeric SMILES

CN(C)CCN(C1=NC2=C(S1)C=CC=C2S(=O)(=O)C)C(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C19H21N3O3S3/c1-21(2)11-12-22(17(23)10-9-14-6-5-13-26-14)19-20-18-15(27-19)7-4-8-16(18)28(3,24)25/h4-10,13H,11-12H2,1-3H3/b10-9+