phenyl (E)-3-(1,3-benzothiazol-2-ylsulfanyl)-3-methoxy-2-methyl-prop-2-enoate

Systemtic Name: phenyl (E)-3-(1,3-benzothiazol-2-ylsulfanyl)-3-methoxy-2-methyl-prop-2-enoate Openeye Name: phenyl (E)-3-(1,3-benzothiazol-2-ylsulfanyl)-3-methoxy-2-methyl-prop-2-enoate CAS Name: (E)-3-(1,3-benzothiazol-2-ylthio)-3-methoxy-2-methyl-2-propenoic acid phenyl ester IUPAC Name: phenyl (E)-3-(1,3-benzothiazol-2-ylsulfanyl)-3-methoxy-2-methylprop-2-enoate Traditional Name: (E)-3-(1,3-benzothiazol-2-ylthio)-3-methoxy-2-methyl-acrylic acid phenyl ester Formula: C18H15NO3S2 MolecularWeight: 357.4466

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(OC)SC1=NC2=CC=CC=C2S1)C(=O)OC3=CC=CC=C3

Isomeric SMILES

C/C(=C(/OC)\SC1=NC2=CC=CC=C2S1)/C(=O)OC3=CC=CC=C3

InChI

InChI=1S/C18H15NO3S2/c1-12(16(20)22-13-8-4-3-5-9-13)17(21-2)24-18-19-14-10-6-7-11-15(14)23-18/h3-11H,1-2H3/b17-12+