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

Systemtic Name: (E)-N-(2-diethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-phenyl-prop-2-enamide Openeye Name: (E)-N-(2-diethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-phenyl-prop-2-enamide CAS Name: (E)-N-(2-diethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-phenyl-2-propenamide IUPAC Name: (E)-N-(2-diethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-phenylprop-2-enamide Traditional Name: (E)-N-(2-diethylaminoethyl)-N-(6-mesyl-1,3-benzothiazol-2-yl)-3-phenyl-acrylamide Formula: C23H27N3O3S2 MolecularWeight: 457.60878

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C)C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C)C(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C23H27N3O3S2/c1-4-25(5-2)15-16-26(22(27)14-11-18-9-7-6-8-10-18)23-24-20-13-12-19(31(3,28)29)17-21(20)30-23/h6-14,17H,4-5,15-16H2,1-3H3/b14-11+