N-(1-adamantylmethyl)-1-(4-azanyl-5-methyl-pyrimidin-2-yl)-3-methyl-pyrazole-4-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-1-(4-azanyl-5-methyl-pyrimidin-2-yl)-3-methyl-pyrazole-4-carboxamide Openeye Name: N-(1-adamantylmethyl)-1-(4-amino-5-methyl-pyrimidin-2-yl)-3-methyl-pyrazole-4-carboxamide CAS Name: N-(1-adamantylmethyl)-1-(4-amino-5-methyl-2-pyrimidinyl)-3-methyl-4-pyrazolecarboxamide IUPAC Name: N-(1-adamantylmethyl)-1-(4-amino-5-methylpyrimidin-2-yl)-3-methylpyrazole-4-carboxamide Traditional Name: N-(1-adamantylmethyl)-1-(4-amino-5-methyl-pyrimidin-2-yl)-3-methyl-pyrazole-4-carboxamide Formula: C21H28N6O MolecularWeight: 380.48662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1N)N2C=C(C(=N2)C)C(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CN=C(N=C1N)N2C=C(C(=N2)C)C(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H28N6O/c1-12-9-23-20(25-18(12)22)27-10-17(13(2)26-27)19(28)24-11-21-6-14-3-15(7-21)5-16(4-14)8-21/h9-10,14-16H,3-8,11H2,1-2H3,(H,24,28)(H2,22,23,25)