2-(3,5-dimethyl-4-propan-2-yl-pyrazol-1-yl)-6-nitro-1,3-benzothiazole

Systemtic Name: 2-(3,5-dimethyl-4-propan-2-yl-pyrazol-1-yl)-6-nitro-1,3-benzothiazole Openeye Name: 2-(4-isopropyl-3,5-dimethyl-pyrazol-1-yl)-6-nitro-1,3-benzothiazole CAS Name: 2-(3,5-dimethyl-4-propan-2-yl-1-pyrazolyl)-6-nitro-1,3-benzothiazole IUPAC Name: 2-(3,5-dimethyl-4-propan-2-ylpyrazol-1-yl)-6-nitro-1,3-benzothiazole Traditional Name: 2-(4-isopropyl-3,5-dimethyl-pyrazol-1-yl)-6-nitro-1,3-benzothiazole Formula: C15H16N4O2S MolecularWeight: 316.37814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C)C(C)C

Isomeric SMILES

CC1=C(C(=NN1C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C)C(C)C

InChI

InChI=1S/C15H16N4O2S/c1-8(2)14-9(3)17-18(10(14)4)15-16-12-6-5-11(19(20)21)7-13(12)22-15/h5-8H,1-4H3