1,3-benzothiazol-2-ylmethyl (E)-3-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]prop-2-enoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl (E)-3-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]prop-2-enoate Openeye Name: 1,3-benzothiazol-2-ylmethyl (E)-3-[2-(4-methoxyphenyl)thiazol-4-yl]prop-2-enoate CAS Name: (E)-3-[2-(4-methoxyphenyl)-4-thiazolyl]-2-propenoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl (E)-3-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]prop-2-enoate Traditional Name: (E)-3-[2-(4-methoxyphenyl)thiazol-4-yl]acrylic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C21H16N2O3S2 MolecularWeight: 408.49334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=CS2)C=CC(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=CS2)/C=C/C(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H16N2O3S2/c1-25-16-9-6-14(7-10-16)21-22-15(13-27-21)8-11-20(24)26-12-19-23-17-4-2-3-5-18(17)28-19/h2-11,13H,12H2,1H3/b11-8+