(3,4-dimethylphenyl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate

Systemtic Name: (3,4-dimethylphenyl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Openeye Name: (3,4-dimethylphenyl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-2-propenoic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)acrylic acid (3,4-dimethylphenyl) ester Formula: C18H15NO2S MolecularWeight: 309.3822

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15NO2S/c1-12-7-8-14(11-13(12)2)21-18(20)10-9-17-19-15-5-3-4-6-16(15)22-17/h3-11H,1-2H3/b10-9+