N-[(1R)-1-(1-adamantyl)ethyl]-3-butyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[(1R)-1-(1-adamantyl)ethyl]-3-butyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(1R)-1-(1-adamantyl)ethyl]-3-butyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(1R)-1-(1-adamantyl)ethyl]-3-butyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(1R)-1-(1-adamantyl)ethyl]-3-butyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[(1R)-1-(1-adamantyl)ethyl]-3-butyl-4-keto-phthalazine-1-carboxamide Formula: C25H33N3O2 MolecularWeight: 407.54842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC(C)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N[C@H](C)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H33N3O2/c1-3-4-9-28-24(30)21-8-6-5-7-20(21)22(27-28)23(29)26-16(2)25-13-17-10-18(14-25)12-19(11-17)15-25/h5-8,16-19H,3-4,9-15H2,1-2H3,(H,26,29)/t16-,17?,18?,19?,25?/m1/s1