ethyl (E)-3-azanyl-3-(phenylmethylsulfanyl)-2-(5-phenyl-1,3,4-oxadiazol-2-yl)prop-2-enoate

Systemtic Name: ethyl (E)-3-azanyl-3-(phenylmethylsulfanyl)-2-(5-phenyl-1,3,4-oxadiazol-2-yl)prop-2-enoate Openeye Name: ethyl (E)-3-amino-3-benzylsulfanyl-2-(5-phenyl-1,3,4-oxadiazol-2-yl)prop-2-enoate CAS Name: (E)-3-amino-3-(phenylmethylthio)-2-(5-phenyl-1,3,4-oxadiazol-2-yl)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-amino-3-benzylsulfanyl-2-(5-phenyl-1,3,4-oxadiazol-2-yl)prop-2-enoate Traditional Name: (E)-3-amino-3-(benzylthio)-2-(5-phenyl-1,3,4-oxadiazol-2-yl)acrylic acid ethyl ester Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(N)SCC1=CC=CC=C1)C2=NN=C(O2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)/C(=C(\N)/SCC1=CC=CC=C1)/C2=NN=C(O2)C3=CC=CC=C3

InChI

InChI=1S/C20H19N3O3S/c1-2-25-20(24)16(17(21)27-13-14-9-5-3-6-10-14)19-23-22-18(26-19)15-11-7-4-8-12-15/h3-12H,2,13,21H2,1H3/b17-16+