2-(4-chloranyl-2-nitro-phenoxy)-1-[2,5-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)pyrrol-3-yl]ethanone

Systemtic Name: 2-(4-chloranyl-2-nitro-phenoxy)-1-[2,5-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)pyrrol-3-yl]ethanone Openeye Name: 2-(4-chloro-2-nitro-phenoxy)-1-[2,5-dimethyl-1-(4-methylthiazol-2-yl)pyrrol-3-yl]ethanone CAS Name: 2-(4-chloro-2-nitrophenoxy)-1-[2,5-dimethyl-1-(4-methyl-2-thiazolyl)-3-pyrrolyl]ethanone IUPAC Name: 2-(4-chloro-2-nitrophenoxy)-1-[2,5-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)pyrrol-3-yl]ethanone Traditional Name: 2-(4-chloro-2-nitro-phenoxy)-1-[2,5-dimethyl-1-(4-methylthiazol-2-yl)pyrrol-3-yl]ethanone Formula: C18H16ClN3O4S MolecularWeight: 405.85534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=NC(=CS2)C)C)C(=O)COC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1C2=NC(=CS2)C)C)C(=O)COC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H16ClN3O4S/c1-10-9-27-18(20-10)21-11(2)6-14(12(21)3)16(23)8-26-17-5-4-13(19)7-15(17)22(24)25/h4-7,9H,8H2,1-3H3