(E)-N-(5,6-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-(5,6-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-phenyl-prop-2-enamide Openeye Name: (E)-N-(5,6-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-phenyl-prop-2-enamide CAS Name: (E)-N-(5,6-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-phenyl-2-propenamide IUPAC Name: (E)-N-(5,6-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-phenylprop-2-enamide Traditional Name: (E)-N-(5,6-dimethoxy-3-propargyl-1,3-benzothiazol-2-ylidene)-3-phenyl-acrylamide Formula: C21H18N2O3S MolecularWeight: 378.44422

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N(C(=NC(=O)C=CC3=CC=CC=C3)S2)CC#C)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N(C(=NC(=O)/C=C/C3=CC=CC=C3)S2)CC#C)OC

InChI

InChI=1S/C21H18N2O3S/c1-4-12-23-16-13-17(25-2)18(26-3)14-19(16)27-21(23)22-20(24)11-10-15-8-6-5-7-9-15/h1,5-11,13-14H,12H2,2-3H3/b11-10+,22-21?