4-oxidanyl-2-phenyl-1-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one

Systemtic Name: 4-oxidanyl-2-phenyl-1-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Openeye Name: 1-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-hydroxy-2-phenyl-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one CAS Name: 4-hydroxy-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2-phenyl-1-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]-2H-pyrrol-5-one IUPAC Name: 1-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-hydroxy-2-phenyl-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Traditional Name: 1-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-3-hydroxy-5-phenyl-4-[(E)-3-phenylacryloyl]-3-pyrrolin-2-one Formula: C28H21N3O3S2 MolecularWeight: 511.61464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=C(S2)N3C(C(=C(C3=O)O)C(=O)C=CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C(S2)N3C(C(=C(C3=O)O)C(=O)/C=C/C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H21N3O3S2/c32-22(17-16-19-10-4-1-5-11-19)23-24(21-14-8-3-9-15-21)31(26(34)25(23)33)27-29-30-28(36-27)35-18-20-12-6-2-7-13-20/h1-17,24,33H,18H2/b17-16+