(3-chloranyl-6-nitro-1-benzothiophen-2-yl)-(3,5-dimethylpyrazol-1-yl)methanone

Systemtic Name: (3-chloranyl-6-nitro-1-benzothiophen-2-yl)-(3,5-dimethylpyrazol-1-yl)methanone Openeye Name: (3-chloro-6-nitro-benzothiophen-2-yl)-(3,5-dimethylpyrazol-1-yl)methanone CAS Name: (3-chloro-6-nitro-1-benzothiophen-2-yl)-(3,5-dimethyl-1-pyrazolyl)methanone IUPAC Name: (3-chloro-6-nitro-1-benzothiophen-2-yl)-(3,5-dimethylpyrazol-1-yl)methanone Traditional Name: (3-chloro-6-nitro-benzothiophen-2-yl)-(3,5-dimethylpyrazol-1-yl)methanone Formula: C14H10ClN3O3S MolecularWeight: 335.7655

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)C2=C(C3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1=CC(=NN1C(=O)C2=C(C3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C14H10ClN3O3S/c1-7-5-8(2)17(16-7)14(19)13-12(15)10-4-3-9(18(20)21)6-11(10)22-13/h3-6H,1-2H3