N-(4-methoxyphenyl)-4-[4-(3-methoxyphenyl)piperazin-1-yl]phthalazine-1-carboxamide

Systemtic Name: N-(4-methoxyphenyl)-4-[4-(3-methoxyphenyl)piperazin-1-yl]phthalazine-1-carboxamide Openeye Name: N-(4-methoxyphenyl)-4-[4-(3-methoxyphenyl)piperazin-1-yl]phthalazine-1-carboxamide CAS Name: N-(4-methoxyphenyl)-4-[4-(3-methoxyphenyl)-1-piperazinyl]-1-phthalazinecarboxamide IUPAC Name: N-(4-methoxyphenyl)-4-[4-(3-methoxyphenyl)piperazin-1-yl]phthalazine-1-carboxamide Traditional Name: N-(4-methoxyphenyl)-4-[4-(3-methoxyphenyl)piperazino]phthalazine-1-carboxamide Formula: C27H27N5O3 MolecularWeight: 469.53498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=NN=C(C3=CC=CC=C32)N4CCN(CC4)C5=CC(=CC=C5)OC

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=NN=C(C3=CC=CC=C32)N4CCN(CC4)C5=CC(=CC=C5)OC

InChI

InChI=1S/C27H27N5O3/c1-34-21-12-10-19(11-13-21)28-27(33)25-23-8-3-4-9-24(23)26(30-29-25)32-16-14-31(15-17-32)20-6-5-7-22(18-20)35-2/h3-13,18H,14-17H2,1-2H3,(H,28,33)