(E)-N-(2-dimethylaminoethyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-(2-dimethylaminoethyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-3-phenyl-prop-2-enamide Openeye Name: (E)-N-(2-dimethylaminoethyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-3-phenyl-prop-2-enamide CAS Name: (E)-N-(2-dimethylaminoethyl)-N-[6-(methylthio)-1,3-benzothiazol-2-yl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-(2-dimethylaminoethyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-3-phenylprop-2-enamide Traditional Name: (E)-N-(2-dimethylaminoethyl)-N-[6-(methylthio)-1,3-benzothiazol-2-yl]-3-phenyl-acrylamide Formula: C21H23N3OS2 MolecularWeight: 397.55682

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3OS2/c1-23(2)13-14-24(20(25)12-9-16-7-5-4-6-8-16)21-22-18-11-10-17(26-3)15-19(18)27-21/h4-12,15H,13-14H2,1-3H3/b12-9+