N-(4,7-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-(4-methylsulfanylphenyl)ethanamide

Systemtic Name: N-(4,7-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-(4-methylsulfanylphenyl)ethanamide Openeye Name: N-(4,7-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-(4-methylsulfanylphenyl)acetamide CAS Name: N-(4,7-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-[4-(methylthio)phenyl]acetamide IUPAC Name: N-(4,7-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-(4-methylsulfanylphenyl)acetamide Traditional Name: N-(4,7-dimethoxy-3-propargyl-1,3-benzothiazol-2-ylidene)-2-[4-(methylthio)phenyl]acetamide Formula: C21H20N2O3S2 MolecularWeight: 412.5251

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)OC)SC(=NC(=O)CC3=CC=C(C=C3)SC)N2CC#C

Isomeric SMILES

COC1=C2C(=C(C=C1)OC)SC(=NC(=O)CC3=CC=C(C=C3)SC)N2CC#C

InChI

InChI=1S/C21H20N2O3S2/c1-5-12-23-19-16(25-2)10-11-17(26-3)20(19)28-21(23)22-18(24)13-14-6-8-15(27-4)9-7-14/h1,6-11H,12-13H2,2-4H3