(E)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-[4-(diethylamino)phenyl]prop-2-enoate

Systemtic Name: (E)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-[4-(diethylamino)phenyl]prop-2-enoate Openeye Name: (E)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-[4-(diethylamino)phenyl]prop-2-enoate CAS Name: (E)-2-(1,3-benzoxazol-2-ylthio)-3-[4-(diethylamino)phenyl]-2-propenoate IUPAC Name: (E)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-[4-(diethylamino)phenyl]prop-2-enoate Traditional Name: (E)-2-(1,3-benzoxazol-2-ylthio)-3-[4-(diethylamino)phenyl]acrylate Formula: C20H19N2O3S- MolecularWeight: 367.44146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O3S/c1-3-22(4-2)15-11-9-14(10-12-15)13-18(19(23)24)26-20-21-16-7-5-6-8-17(16)25-20/h5-13H,3-4H2,1-2H3,(H,23,24)/p-1/b18-13+