5-phenyl-N-[5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1,4-oxathiine-6-carboxamide

Systemtic Name: 5-phenyl-N-[5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[5-[(E)-cinnamyl]sulfanyl-1,3,4-thiadiazol-2-yl]-5-phenyl-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: 5-phenyl-N-[5-[[(E)-3-phenylprop-2-enyl]thio]-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: 5-phenyl-N-[5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[5-[[(E)-cinnamyl]thio]-1,3,4-thiadiazol-2-yl]-5-phenyl-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C22H19N3O2S3 MolecularWeight: 453.60016

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=C(O1)C(=O)NC2=NN=C(S2)SCC=CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CSC(=C(O1)C(=O)NC2=NN=C(S2)SC/C=C/C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H19N3O2S3/c26-20(18-19(28-15-13-27-18)17-11-5-2-6-12-17)23-21-24-25-22(30-21)29-14-7-10-16-8-3-1-4-9-16/h1-12H,13-15H2,(H,23,24,26)/b10-7+