N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-3-isopropyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazinyl)-3-methylphenyl]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)-3-methylphenyl]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: N-[4-(4-ethylpiperazino)-3-methyl-phenyl]-3-isopropyl-4-keto-phthalazine-1-carboxamide Formula: C25H31N5O2 MolecularWeight: 433.54594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C(C)C)C

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C(C)C)C

InChI

InChI=1S/C25H31N5O2/c1-5-28-12-14-29(15-13-28)22-11-10-19(16-18(22)4)26-24(31)23-20-8-6-7-9-21(20)25(32)30(27-23)17(2)3/h6-11,16-17H,5,12-15H2,1-4H3,(H,26,31)