methyl (E)-2-[2-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]-3-methoxy-prop-2-enoate

Systemtic Name: methyl (E)-2-[2-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]-3-methoxy-prop-2-enoate Openeye Name: methyl (E)-2-[2-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]-3-methoxy-prop-2-enoate CAS Name: (E)-2-[2-[(1,3-benzothiazol-2-ylthio)methyl]phenyl]-3-methoxy-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-[2-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]-3-methoxyprop-2-enoate Traditional Name: (E)-2-[2-[(1,3-benzothiazol-2-ylthio)methyl]phenyl]-3-methoxy-acrylic acid methyl ester Formula: C19H17NO3S2 MolecularWeight: 371.47318

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Descriptors Computed from Structure

Canonical SMILES:

COC=C(C1=CC=CC=C1CSC2=NC3=CC=CC=C3S2)C(=O)OC

Isomeric SMILES

CO/C=C(\C1=CC=CC=C1CSC2=NC3=CC=CC=C3S2)/C(=O)OC

InChI

InChI=1S/C19H17NO3S2/c1-22-11-15(18(21)23-2)14-8-4-3-7-13(14)12-24-19-20-16-9-5-6-10-17(16)25-19/h3-11H,12H2,1-2H3/b15-11+