N-(6-methyl-1,3-benzothiazol-2-yl)-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-(6-methyl-1,3-benzothiazol-2-yl)-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-(6-methyl-1,3-benzothiazol-2-yl)-3-nitro-1H-pyrazole-5-carboxamide CAS Name: N-(6-methyl-1,3-benzothiazol-2-yl)-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-(6-methyl-1,3-benzothiazol-2-yl)-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-(6-methyl-1,3-benzothiazol-2-yl)-3-nitro-1H-pyrazole-5-carboxamide Formula: C12H9N5O3S MolecularWeight: 303.29656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=NN3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=NN3)[N+](=O)[O-]

InChI

InChI=1S/C12H9N5O3S/c1-6-2-3-7-9(4-6)21-12(13-7)14-11(18)8-5-10(16-15-8)17(19)20/h2-5H,1H3,(H,15,16)(H,13,14,18)