N-[2-(4-thiomorpholin-4-ylcarbonyl-1,2,3-triazol-1-yl)ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-(4-thiomorpholin-4-ylcarbonyl-1,2,3-triazol-1-yl)ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[4-(thiomorpholine-4-carbonyl)triazol-1-yl]ethyl]adamantane-1-carboxamide CAS Name: N-[2-[4-[oxo(thiomorpholin-4-yl)methyl]-1-triazolyl]ethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[4-(thiomorpholine-4-carbonyl)triazol-1-yl]ethyl]adamantane-1-carboxamide Traditional Name: N-[2-[4-(thiomorpholine-4-carbonyl)triazol-1-yl]ethyl]adamantane-1-carboxamide Formula: C20H29N5O2S MolecularWeight: 403.54156

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1C(=O)C2=CN(N=N2)CCNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CSCCN1C(=O)C2=CN(N=N2)CCNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C20H29N5O2S/c26-18(24-3-5-28-6-4-24)17-13-25(23-22-17)2-1-21-19(27)20-10-14-7-15(11-20)9-16(8-14)12-20/h13-16H,1-12H2,(H,21,27)