5-(1-adamantyl)-3-[[(3-nitrophenyl)amino]methyl]-1,3,4-oxadiazole-2-thione

Systemtic Name: 5-(1-adamantyl)-3-[[(3-nitrophenyl)amino]methyl]-1,3,4-oxadiazole-2-thione Openeye Name: 5-(1-adamantyl)-3-[(3-nitroanilino)methyl]-1,3,4-oxadiazole-2-thione CAS Name: 5-(1-adamantyl)-3-[(3-nitroanilino)methyl]-1,3,4-oxadiazole-2-thione IUPAC Name: 5-(1-adamantyl)-3-[(3-nitroanilino)methyl]-1,3,4-oxadiazole-2-thione Traditional Name: 5-(1-adamantyl)-3-[(3-nitroanilino)methyl]-1,3,4-oxadiazole-2-thione Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NN(C(=S)O4)CNC5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NN(C(=S)O4)CNC5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O3S/c24-23(25)16-3-1-2-15(7-16)20-11-22-18(27)26-17(21-22)19-8-12-4-13(9-19)6-14(5-12)10-19/h1-3,7,12-14,20H,4-6,8-11H2