N-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]adamantane-1-carboxamide

Systemtic Name: N-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]adamantane-1-carboxamide Openeye Name: N-[(2,4-diaminopyrimidin-5-yl)methyl]adamantane-1-carboxamide CAS Name: N-[(2,4-diamino-5-pyrimidinyl)methyl]-1-adamantanecarboxamide IUPAC Name: N-[(2,4-diaminopyrimidin-5-yl)methyl]adamantane-1-carboxamide Traditional Name: N-[(2,4-diaminopyrimidin-5-yl)methyl]adamantane-1-carboxamide Formula: C16H23N5O MolecularWeight: 301.38672

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCC4=CN=C(N=C4N)N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCC4=CN=C(N=C4N)N

InChI

InChI=1S/C16H23N5O/c17-13-12(8-20-15(18)21-13)7-19-14(22)16-4-9-1-10(5-16)3-11(2-9)6-16/h8-11H,1-7H2,(H,19,22)(H4,17,18,20,21)