5-(4-chloranylpyrazol-1-yl)-1-cyclopropyl-N-[(1S,3S)-5-oxidanyl-2-adamantyl]pyrazole-4-carboxamide

Systemtic Name: 5-(4-chloranylpyrazol-1-yl)-1-cyclopropyl-N-[(1S,3S)-5-oxidanyl-2-adamantyl]pyrazole-4-carboxamide Openeye Name: 5-(4-chloropyrazol-1-yl)-1-cyclopropyl-N-[(1S,3S)-5-hydroxy-2-adamantyl]pyrazole-4-carboxamide CAS Name: 5-(4-chloro-1-pyrazolyl)-1-cyclopropyl-N-[(1S,3S)-5-hydroxy-2-adamantyl]-4-pyrazolecarboxamide IUPAC Name: 5-(4-chloropyrazol-1-yl)-1-cyclopropyl-N-[(1S,3S)-5-hydroxy-2-adamantyl]pyrazole-4-carboxamide Traditional Name: 5-(4-chloropyrazol-1-yl)-1-cyclopropyl-N-[(1S,3S)-5-hydroxy-2-adamantyl]pyrazole-4-carboxamide Formula: C20H24ClN5O2 MolecularWeight: 401.88986

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=C(C=N2)C(=O)NC3C4CC5CC3CC(C5)(C4)O)N6C=C(C=N6)Cl

Isomeric SMILES

C1CC1N2C(=C(C=N2)C(=O)NC3[C@H]4CC5C[C@H]3CC(C4)(C5)O)N6C=C(C=N6)Cl

InChI

InChI=1S/C20H24ClN5O2/c21-14-8-22-25(10-14)19-16(9-23-26(19)15-1-2-15)18(27)24-17-12-3-11-4-13(17)7-20(28,5-11)6-12/h8-13,15,17,28H,1-7H2,(H,24,27)/t11?,12-,13-,17?,20?/m0/s1