N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]adamantane-1-carboxamide Openeye Name: N-[4-(4-nitrophenyl)thiazol-2-yl]adamantane-1-carboxamide CAS Name: N-[4-(4-nitrophenyl)-2-thiazolyl]-1-adamantanecarboxamide IUPAC Name: N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]adamantane-1-carboxamide Traditional Name: N-[4-(4-nitrophenyl)thiazol-2-yl]adamantane-1-carboxamide Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=NC(=CS4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=NC(=CS4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O3S/c24-18(20-8-12-5-13(9-20)7-14(6-12)10-20)22-19-21-17(11-27-19)15-1-3-16(4-2-15)23(25)26/h1-4,11-14H,5-10H2,(H,21,22,24)