3-(3-methoxyphenyl)-5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]-1,2,4-oxadiazole

Systemtic Name: 3-(3-methoxyphenyl)-5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]-1,2,4-oxadiazole Openeye Name: 3-(3-methoxyphenyl)-5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]-1,2,4-oxadiazole CAS Name: 3-(3-methoxyphenyl)-5-[[(6-nitro-1,3-benzothiazol-2-yl)thio]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(3-methoxyphenyl)-5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]-1,2,4-oxadiazole Traditional Name: 3-(3-methoxyphenyl)-5-[[(6-nitro-1,3-benzothiazol-2-yl)thio]methyl]-1,2,4-oxadiazole Formula: C17H12N4O4S2 MolecularWeight: 400.43158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NOC(=N2)CSC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C2=NOC(=N2)CSC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H12N4O4S2/c1-24-12-4-2-3-10(7-12)16-19-15(25-20-16)9-26-17-18-13-6-5-11(21(22)23)8-14(13)27-17/h2-8H,9H2,1H3