N-(1-adamantylmethyl)-5-[(3-imidazol-1-ylpropylamino)methyl]-2-propan-2-yl-pyrazole-3-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-5-[(3-imidazol-1-ylpropylamino)methyl]-2-propan-2-yl-pyrazole-3-carboxamide Openeye Name: N-(1-adamantylmethyl)-5-[(3-imidazol-1-ylpropylamino)methyl]-2-isopropyl-pyrazole-3-carboxamide CAS Name: N-(1-adamantylmethyl)-5-[[3-(1-imidazolyl)propylamino]methyl]-2-propan-2-yl-3-pyrazolecarboxamide IUPAC Name: N-(1-adamantylmethyl)-5-[(3-imidazol-1-ylpropylamino)methyl]-2-propan-2-ylpyrazole-3-carboxamide Traditional Name: N-(1-adamantylmethyl)-5-[(3-imidazol-1-ylpropylamino)methyl]-2-isopropyl-pyrazole-3-carboxamide Formula: C25H38N6O MolecularWeight: 438.60882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=CC(=N1)CNCCCN2C=CN=C2)C(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C)N1C(=CC(=N1)CNCCCN2C=CN=C2)C(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H38N6O/c1-18(2)31-23(11-22(29-31)15-26-4-3-6-30-7-5-27-17-30)24(32)28-16-25-12-19-8-20(13-25)10-21(9-19)14-25/h5,7,11,17-21,26H,3-4,6,8-10,12-16H2,1-2H3,(H,28,32)