(5S,7R)-3-chloranyl-N-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]adamantane-1-carboxamide

Systemtic Name: (5S,7R)-3-chloranyl-N-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]adamantane-1-carboxamide Openeye Name: (5S,7R)-3-chloro-N-[2-oxo-2-(thiazol-2-ylamino)ethyl]adamantane-1-carboxamide CAS Name: (5S,7R)-3-chloro-N-[2-oxo-2-(2-thiazolylamino)ethyl]-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-chloro-N-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]adamantane-1-carboxamide Traditional Name: (5S,7R)-3-chloro-N-[2-keto-2-(thiazol-2-ylamino)ethyl]adamantane-1-carboxamide Formula: C16H20ClN3O2S MolecularWeight: 353.8669

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)Cl)C(=O)NCC(=O)NC4=NC=CS4

Isomeric SMILES

C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)Cl)C(=O)NCC(=O)NC4=NC=CS4

InChI

InChI=1S/C16H20ClN3O2S/c17-16-6-10-3-11(7-16)5-15(4-10,9-16)13(22)19-8-12(21)20-14-18-1-2-23-14/h1-2,10-11H,3-9H2,(H,19,22)(H,18,20,21)/t10-,11+,15?,16?