ethyl (E)-3-[3-aminocarbonyl-5-[(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[3-aminocarbonyl-5-[(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]phenyl]prop-2-enoate Openeye Name: ethyl (E)-3-[3-carbamoyl-5-[[5-(2-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]phenyl]prop-2-enoate CAS Name: (E)-3-[3-carbamoyl-5-[[[5-(2-pyridinyl)-1,3,4-oxadiazol-2-yl]thio]methyl]phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[3-carbamoyl-5-[(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]phenyl]prop-2-enoate Traditional Name: (E)-3-[3-carbamoyl-5-[[[5-(2-pyridyl)-1,3,4-oxadiazol-2-yl]thio]methyl]phenyl]acrylic acid ethyl ester Formula: C20H18N4O4S MolecularWeight: 410.44632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=CC(=CC(=C1)CSC2=NN=C(O2)C3=CC=CC=N3)C(=O)N

Isomeric SMILES

CCOC(=O)/C=C/C1=CC(=CC(=C1)CSC2=NN=C(O2)C3=CC=CC=N3)C(=O)N

InChI

InChI=1S/C20H18N4O4S/c1-2-27-17(25)7-6-13-9-14(11-15(10-13)18(21)26)12-29-20-24-23-19(28-20)16-5-3-4-8-22-16/h3-11H,2,12H2,1H3,(H2,21,26)/b7-6+