(E)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-(4-propan-2-ylphenyl)prop-2-enoate

Systemtic Name: (E)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-(4-propan-2-ylphenyl)prop-2-enoate Openeye Name: (E)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-(4-isopropylphenyl)prop-2-enoate CAS Name: (E)-2-(1,3-benzoxazol-2-ylthio)-3-(4-propan-2-ylphenyl)-2-propenoate IUPAC Name: (E)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-(4-propan-2-ylphenyl)prop-2-enoate Traditional Name: (E)-2-(1,3-benzoxazol-2-ylthio)-3-p-cumenyl-acrylate Formula: C19H16NO3S- MolecularWeight: 338.40024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=C(C(=O)[O-])SC2=NC3=CC=CC=C3O2

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C(\C(=O)[O-])/SC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C19H17NO3S/c1-12(2)14-9-7-13(8-10-14)11-17(18(21)22)24-19-20-15-5-3-4-6-16(15)23-19/h3-12H,1-2H3,(H,21,22)/p-1/b17-11+