(3,5-dimethylphenyl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate

Systemtic Name: (3,5-dimethylphenyl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Openeye Name: (3,5-dimethylphenyl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-2-propenoic acid (3,5-dimethylphenyl) ester IUPAC Name: (3,5-dimethylphenyl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)acrylic acid (3,5-dimethylphenyl) ester Formula: C18H15NO2S MolecularWeight: 309.3822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC(=O)C=CC2=NC3=CC=CC=C3S2)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC(=O)/C=C/C2=NC3=CC=CC=C3S2)C

InChI

InChI=1S/C18H15NO2S/c1-12-9-13(2)11-14(10-12)21-18(20)8-7-17-19-15-5-3-4-6-16(15)22-17/h3-11H,1-2H3/b8-7+