3-methyl-4-oxidanylidene-N-[(1S)-1-phenylbutyl]phthalazine-1-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-N-[(1S)-1-phenylbutyl]phthalazine-1-carboxamide Openeye Name: 3-methyl-4-oxo-N-[(1S)-1-phenylbutyl]phthalazine-1-carboxamide CAS Name: 3-methyl-4-oxo-N-[(1S)-1-phenylbutyl]-1-phthalazinecarboxamide IUPAC Name: 3-methyl-4-oxo-N-[(1S)-1-phenylbutyl]phthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[(1S)-1-phenylbutyl]phthalazine-1-carboxamide Formula: C20H21N3O2 MolecularWeight: 335.39964

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

CCC[C@@H](C1=CC=CC=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C20H21N3O2/c1-3-9-17(14-10-5-4-6-11-14)21-19(24)18-15-12-7-8-13-16(15)20(25)23(2)22-18/h4-8,10-13,17H,3,9H2,1-2H3,(H,21,24)/t17-/m0/s1