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

Systemtic Name: 3-(2-methylphenyl)-5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]-1,2,4-oxadiazole Openeye Name: 5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]-3-(o-tolyl)-1,2,4-oxadiazole CAS Name: 3-(2-methylphenyl)-5-[[(6-nitro-1,3-benzothiazol-2-yl)thio]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(2-methylphenyl)-5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]-1,2,4-oxadiazole Traditional Name: 5-[[(6-nitro-1,3-benzothiazol-2-yl)thio]methyl]-3-(o-tolyl)-1,2,4-oxadiazole Formula: C17H12N4O3S2 MolecularWeight: 384.43218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NOC(=N2)CSC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C2=NOC(=N2)CSC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H12N4O3S2/c1-10-4-2-3-5-12(10)16-19-15(24-20-16)9-25-17-18-13-7-6-11(21(22)23)8-14(13)26-17/h2-8H,9H2,1H3