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

Systemtic Name: N-[5,6-dimethoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-3,5-dimethoxy-benzamide Openeye Name: N-[5,6-dimethoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-3,5-dimethoxy-benzamide CAS Name: N-[5,6-dimethoxy-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]-3,5-dimethoxybenzamide IUPAC Name: N-[5,6-dimethoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-3,5-dimethoxybenzamide Traditional Name: N-[5,6-dimethoxy-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]-3,5-dimethoxy-benzamide Formula: C21H24N2O5S2 MolecularWeight: 448.55566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)N=C2N(C3=CC(=C(C=C3S2)OC)OC)CCSC)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)N=C2N(C3=CC(=C(C=C3S2)OC)OC)CCSC)OC

InChI

InChI=1S/C21H24N2O5S2/c1-25-14-8-13(9-15(10-14)26-2)20(24)22-21-23(6-7-29-5)16-11-17(27-3)18(28-4)12-19(16)30-21/h8-12H,6-7H2,1-5H3