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

Systemtic Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(1-phenylethyl)phthalazine-1-carboxamide Openeye Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(1-phenylethyl)phthalazine-1-carboxamide CAS Name: 4-[4-(3-methoxyphenyl)-1-piperazinyl]-N-(1-phenylethyl)-1-phthalazinecarboxamide IUPAC Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(1-phenylethyl)phthalazine-1-carboxamide Traditional Name: 4-[4-(3-methoxyphenyl)piperazino]-N-(1-phenylethyl)phthalazine-1-carboxamide Formula: C28H29N5O2 MolecularWeight: 467.56216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H29N5O2/c1-20(21-9-4-3-5-10-21)29-28(34)26-24-13-6-7-14-25(24)27(31-30-26)33-17-15-32(16-18-33)22-11-8-12-23(19-22)35-2/h3-14,19-20H,15-18H2,1-2H3,(H,29,34)