N-[(5R)-5-oxidanylidene-2-phenyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]adamantane-1-carboxamide

Systemtic Name: N-[(5R)-5-oxidanylidene-2-phenyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]adamantane-1-carboxamide Openeye Name: N-[(5R)-5-oxo-2-phenyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]adamantane-1-carboxamide CAS Name: N-[(5R)-5-oxo-2-phenyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-1-adamantanecarboxamide IUPAC Name: N-[(5R)-5-oxo-2-phenyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]adamantane-1-carboxamide Traditional Name: N-[(5R)-5-keto-2-phenyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]adamantane-1-carboxamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=C5CS(=O)CC5=NN4C6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=C5C[S@@](=O)CC5=NN4C6=CC=CC=C6

InChI

InChI=1S/C22H25N3O2S/c26-21(22-9-14-6-15(10-22)8-16(7-14)11-22)23-20-18-12-28(27)13-19(18)24-25(20)17-4-2-1-3-5-17/h1-5,14-16H,6-13H2,(H,23,26)/t14?,15?,16?,22?,28-/m1/s1