N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C22H26N4O2 MolecularWeight: 378.46744

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)N(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)N(C)C

InChI

InChI=1S/C22H26N4O2/c1-5-15-10-12-16(13-11-15)19(25(2)3)14-23-21(27)20-17-8-6-7-9-18(17)22(28)26(4)24-20/h6-13,19H,5,14H2,1-4H3,(H,23,27)