(E)-1-(1,3-benzothiazol-2-yl)-3-(2,3-dimethoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(1,3-benzothiazol-2-yl)-3-(2,3-dimethoxyphenyl)prop-2-en-1-one Openeye Name: (E)-1-(1,3-benzothiazol-2-yl)-3-(2,3-dimethoxyphenyl)prop-2-en-1-one CAS Name: (E)-1-(1,3-benzothiazol-2-yl)-3-(2,3-dimethoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(1,3-benzothiazol-2-yl)-3-(2,3-dimethoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-(1,3-benzothiazol-2-yl)-3-(2,3-dimethoxyphenyl)prop-2-en-1-one Formula: C18H15NO3S MolecularWeight: 325.3816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C=CC(=O)C2=NC3=CC=CC=C3S2

Isomeric SMILES

COC1=CC=CC(=C1OC)/C=C/C(=O)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H15NO3S/c1-21-15-8-5-6-12(17(15)22-2)10-11-14(20)18-19-13-7-3-4-9-16(13)23-18/h3-11H,1-2H3/b11-10+