3-(4-chlorophenyl)-4-[2-(2,5-dimethylpyrrol-1-yl)-1,3-thiazol-4-yl]-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 3-(4-chlorophenyl)-4-[2-(2,5-dimethylpyrrol-1-yl)-1,3-thiazol-4-yl]-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-(4-chlorophenyl)-4-[2-(2,5-dimethylpyrrol-1-yl)thiazol-4-yl]oxadiazol-3-ium-5-olate CAS Name: 3-(4-chlorophenyl)-4-[2-(2,5-dimethyl-1-pyrrolyl)-4-thiazolyl]-5-oxadiazol-3-iumolate IUPAC Name: 3-(4-chlorophenyl)-4-[2-(2,5-dimethylpyrrol-1-yl)-1,3-thiazol-4-yl]oxadiazol-3-ium-5-olate Traditional Name: 3-(4-chlorophenyl)-4-[2-(2,5-dimethylpyrrol-1-yl)thiazol-4-yl]oxadiazol-3-ium-5-olate Formula: C17H13ClN4O2S MolecularWeight: 372.82872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=NC(=CS2)C3=C(ON=[N+]3C4=CC=C(C=C4)Cl)[O-])C

Isomeric SMILES

CC1=CC=C(N1C2=NC(=CS2)C3=C(ON=[N+]3C4=CC=C(C=C4)Cl)[O-])C

InChI

InChI=1S/C17H13ClN4O2S/c1-10-3-4-11(2)21(10)17-19-14(9-25-17)15-16(23)24-20-22(15)13-7-5-12(18)6-8-13/h3-9H,1-2H3