2-(4-methoxy-3-methyl-phenyl)-N-(6-methylsulfanyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)ethanamide

Systemtic Name: 2-(4-methoxy-3-methyl-phenyl)-N-(6-methylsulfanyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)ethanamide Openeye Name: N-(3-allyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)-2-(4-methoxy-3-methyl-phenyl)acetamide CAS Name: 2-(4-methoxy-3-methylphenyl)-N-[6-(methylthio)-3-prop-2-enyl-1,3-benzothiazol-2-ylidene]acetamide IUPAC Name: 2-(4-methoxy-3-methylphenyl)-N-(6-methylsulfanyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)acetamide Traditional Name: N-[3-allyl-6-(methylthio)-1,3-benzothiazol-2-ylidene]-2-(4-methoxy-3-methyl-phenyl)acetamide Formula: C21H22N2O2S2 MolecularWeight: 398.54158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O2S2/c1-5-10-23-17-8-7-16(26-4)13-19(17)27-21(23)22-20(24)12-15-6-9-18(25-3)14(2)11-15/h5-9,11,13H,1,10,12H2,2-4H3