N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-isobutyl-N-methyl-N-[2-(4-methylanilino)-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-3-(2-methylpropyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-3-(2-methylpropyl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-isobutyl-4-keto-N-[2-keto-2-(p-toluidino)ethyl]-N-methyl-phthalazine-1-carboxamide Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

InChI

InChI=1S/C23H26N4O3/c1-15(2)13-27-22(29)19-8-6-5-7-18(19)21(25-27)23(30)26(4)14-20(28)24-17-11-9-16(3)10-12-17/h5-12,15H,13-14H2,1-4H3,(H,24,28)