3-methyl-5-[2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoyl]-1,3-benzoxazol-2-one

Systemtic Name: 3-methyl-5-[2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoyl]-1,3-benzoxazol-2-one Openeye Name: 3-methyl-5-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]-1,3-benzoxazol-2-one CAS Name: 3-methyl-5-[1-oxo-2-[(1-phenyl-5-tetrazolyl)thio]ethyl]-1,3-benzoxazol-2-one IUPAC Name: 3-methyl-5-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]-1,3-benzoxazol-2-one Traditional Name: 3-methyl-5-[2-[(1-phenyltetrazol-5-yl)thio]acetyl]-1,3-benzoxazol-2-one Formula: C17H13N5O3S MolecularWeight: 367.38182

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)C(=O)CSC3=NN=NN3C4=CC=CC=C4)OC1=O

Isomeric SMILES

CN1C2=C(C=CC(=C2)C(=O)CSC3=NN=NN3C4=CC=CC=C4)OC1=O

InChI

InChI=1S/C17H13N5O3S/c1-21-13-9-11(7-8-15(13)25-17(21)24)14(23)10-26-16-18-19-20-22(16)12-5-3-2-4-6-12/h2-9H,10H2,1H3