N-(1,3-benzothiazol-2-yl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Formula: C12H9N5O4S MolecularWeight: 319.29596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NNC(=C1[N+](=O)[O-])C(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC1=NNC(=C1[N+](=O)[O-])C(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C12H9N5O4S/c1-21-11-9(17(19)20)8(15-16-11)10(18)14-12-13-6-4-2-3-5-7(6)22-12/h2-5H,1H3,(H,15,16)(H,13,14,18)