N-[6-methoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-2,5-dimethyl-benzamide

Systemtic Name: N-[6-methoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-2,5-dimethyl-benzamide Openeye Name: N-[6-methoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-2,5-dimethyl-benzamide CAS Name: N-[6-methoxy-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]-2,5-dimethylbenzamide IUPAC Name: N-[6-methoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-2,5-dimethylbenzamide Traditional Name: N-[6-methoxy-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]-2,5-dimethyl-benzamide Formula: C20H22N2O2S2 MolecularWeight: 386.53088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)N=C2N(C3=C(S2)C=C(C=C3)OC)CCSC

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)N=C2N(C3=C(S2)C=C(C=C3)OC)CCSC

InChI

InChI=1S/C20H22N2O2S2/c1-13-5-6-14(2)16(11-13)19(23)21-20-22(9-10-25-4)17-8-7-15(24-3)12-18(17)26-20/h5-8,11-12H,9-10H2,1-4H3