N-(5-nitro-1,3-benzothiazol-2-yl)adamantane-1-carboxamide

Systemtic Name: N-(5-nitro-1,3-benzothiazol-2-yl)adamantane-1-carboxamide Openeye Name: N-(5-nitro-1,3-benzothiazol-2-yl)adamantane-1-carboxamide CAS Name: N-(5-nitro-1,3-benzothiazol-2-yl)-1-adamantanecarboxamide IUPAC Name: N-(5-nitro-1,3-benzothiazol-2-yl)adamantane-1-carboxamide Traditional Name: N-(5-nitro-1,3-benzothiazol-2-yl)adamantane-1-carboxamide Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=NC5=C(S4)C=CC(=C5)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=NC5=C(S4)C=CC(=C5)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O3S/c22-16(18-7-10-3-11(8-18)5-12(4-10)9-18)20-17-19-14-6-13(21(23)24)1-2-15(14)25-17/h1-2,6,10-12H,3-5,7-9H2,(H,19,20,22)