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N-(1-adamantylmethyl)-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

N-(1-adamantylmethyl)-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name:N-(1-adamantylmethyl)-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide
Openeye Name:N-(1-adamantylmethyl)-4-oxo-3-pentyl-phthalazine-1-carboxamide
CAS Name:N-(1-adamantylmethyl)-4-oxo-3-pentyl-1-phthalazinecarboxamide
IUPAC Name:N-(1-adamantylmethyl)-4-oxo-3-pentylphthalazine-1-carboxamide
Traditional Name:N-(1-adamantylmethyl)-3-amyl-4-keto-phthalazine-1-carboxamide
Formula: C25H33N3O2
MolecularWeight: 407.54842
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC34CC5CC(C3)CC(C5)C4


Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC34CC5CC(C3)CC(C5)C4


InChI

InChI=1S/C25H33N3O2/c1-2-3-6-9-28-24(30)21-8-5-4-7-20(21)22(27-28)23(29)26-16-25-13-17-10-18(14-25)12-19(11-17)15-25/h4-5,7-8,17-19H,2-3,6,9-16H2,1H3,(H,26,29)


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