N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-5-nitro-2-oxidanylidene-1H-pyridine-3-carboxamide

Systemtic Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-5-nitro-2-oxidanylidene-1H-pyridine-3-carboxamide Openeye Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-5-nitro-2-oxo-1H-pyridine-3-carboxamide CAS Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-5-nitro-2-oxo-1H-pyridine-3-carboxamide IUPAC Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-5-nitro-2-oxo-1H-pyridine-3-carboxamide Traditional Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-keto-5-nitro-1H-pyridine-3-carboxamide Formula: C18H19N5O4S MolecularWeight: 401.43956

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NN=C(S4)NC(=O)C5=CC(=CNC5=O)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NN=C(S4)NC(=O)C5=CC(=CNC5=O)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O4S/c24-14-13(4-12(8-19-14)23(26)27)15(25)20-17-22-21-16(28-17)18-5-9-1-10(6-18)3-11(2-9)7-18/h4,8-11H,1-3,5-7H2,(H,19,24)(H,20,22,25)