N-[2-(1,3-benzothiazol-2-ylmethylamino)-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-ylmethylamino)-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-[2-(1,3-benzothiazol-2-ylmethylamino)-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-[2-(1,3-benzothiazol-2-ylmethylamino)-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-(1,3-benzothiazol-2-ylmethylamino)-2-oxoethyl]adamantane-1-carboxamide Traditional Name: N-[2-(1,3-benzothiazol-2-ylmethylamino)-2-keto-ethyl]adamantane-1-carboxamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCC(=O)NCC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCC(=O)NCC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H25N3O2S/c25-18(22-12-19-24-16-3-1-2-4-17(16)27-19)11-23-20(26)21-8-13-5-14(9-21)7-15(6-13)10-21/h1-4,13-15H,5-12H2,(H,22,25)(H,23,26)