3-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]-5-phenyl-1,2-oxazole

Systemtic Name: 3-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]-5-phenyl-1,2-oxazole Openeye Name: 3-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]-5-phenyl-isoxazole CAS Name: 3-[[(6-nitro-1,3-benzothiazol-2-yl)thio]methyl]-5-phenylisoxazole IUPAC Name: 3-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]-5-phenyl-1,2-oxazole Traditional Name: 3-[[(6-nitro-1,3-benzothiazol-2-yl)thio]methyl]-5-phenyl-isoxazole Formula: C17H11N3O3S2 MolecularWeight: 369.41754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NO2)CSC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NO2)CSC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H11N3O3S2/c21-20(22)13-6-7-14-16(9-13)25-17(18-14)24-10-12-8-15(23-19-12)11-4-2-1-3-5-11/h1-9H,10H2