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

Systemtic Name: (E)-N-(6-ethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-phenyl-prop-2-enamide Openeye Name: (E)-N-(6-ethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-phenyl-prop-2-enamide CAS Name: (E)-N-(6-ethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-phenyl-2-propenamide IUPAC Name: (E)-N-(6-ethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-phenylprop-2-enamide Traditional Name: (E)-N-(6-ethoxy-3-propargyl-1,3-benzothiazol-2-ylidene)-3-phenyl-acrylamide Formula: C21H18N2O2S MolecularWeight: 362.44482

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C=CC3=CC=CC=C3)S2)CC#C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=NC(=O)/C=C/C3=CC=CC=C3)S2)CC#C

InChI

InChI=1S/C21H18N2O2S/c1-3-14-23-18-12-11-17(25-4-2)15-19(18)26-21(23)22-20(24)13-10-16-8-6-5-7-9-16/h1,5-13,15H,4,14H2,2H3/b13-10+,22-21?