3-nitro-N'-[5-nitro-6-(1,3-thiazol-2-ylamino)pyrimidin-4-yl]benzohydrazide

Systemtic Name: 3-nitro-N'-[5-nitro-6-(1,3-thiazol-2-ylamino)pyrimidin-4-yl]benzohydrazide Openeye Name: 3-nitro-N'-[5-nitro-6-(thiazol-2-ylamino)pyrimidin-4-yl]benzohydrazide CAS Name: 3-nitro-N'-[5-nitro-6-(2-thiazolylamino)-4-pyrimidinyl]benzohydrazide IUPAC Name: 3-nitro-N'-[5-nitro-6-(1,3-thiazol-2-ylamino)pyrimidin-4-yl]benzohydrazide Traditional Name: 3-nitro-N'-[5-nitro-6-(thiazol-2-ylamino)pyrimidin-4-yl]benzohydrazide Formula: C14H10N8O5S MolecularWeight: 402.3448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NC3=NC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NC3=NC=CS3

InChI

InChI=1S/C14H10N8O5S/c23-13(8-2-1-3-9(6-8)21(24)25)20-19-12-10(22(26)27)11(16-7-17-12)18-14-15-4-5-28-14/h1-7H,(H,20,23)(H2,15,16,17,18,19)