N-(3-azidophenyl)-6-methyl-2,3-dihydro-1,4-oxathiine-5-carboxamide

Systemtic Name: N-(3-azidophenyl)-6-methyl-2,3-dihydro-1,4-oxathiine-5-carboxamide Openeye Name: N-(3-azidophenyl)-6-methyl-2,3-dihydro-1,4-oxathiine-5-carboxamide CAS Name: N-(3-azidophenyl)-6-methyl-2,3-dihydro-1,4-oxathiin-5-carboxamide IUPAC Name: N-(3-azidophenyl)-6-methyl-2,3-dihydro-1,4-oxathiine-5-carboxamide Traditional Name: N-(3-azidophenyl)-6-methyl-2,3-dihydro-1,4-oxathiin-5-carboxamide Formula: C12H12N4O2S MolecularWeight: 276.31428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SCCO1)C(=O)NC2=CC=CC(=C2)N=[N+]=[N-]

Isomeric SMILES

CC1=C(SCCO1)C(=O)NC2=CC=CC(=C2)N=[N+]=[N-]

InChI

InChI=1S/C12H12N4O2S/c1-8-11(19-6-5-18-8)12(17)14-9-3-2-4-10(7-9)15-16-13/h2-4,7H,5-6H2,1H3,(H,14,17)