1-[1-(6,7-dimethoxyphthalazin-1-yl)piperidin-4-yl]-1-methyl-3-(phenylmethyl)urea hydrochloride

Systemtic Name: 1-[1-(6,7-dimethoxyphthalazin-1-yl)piperidin-4-yl]-1-methyl-3-(phenylmethyl)urea hydrochloride Openeye Name: 3-benzyl-1-[1-(6,7-dimethoxyphthalazin-1-yl)-4-piperidyl]-1-methyl-urea hydrochloride CAS Name: 1-[1-(6,7-dimethoxy-1-phthalazinyl)-4-piperidinyl]-1-methyl-3-(phenylmethyl)urea hydrochloride IUPAC Name: 3-benzyl-1-[1-(6,7-dimethoxyphthalazin-1-yl)piperidin-4-yl]-1-methylurea hydrochloride Traditional Name: 3-benzyl-1-[1-(6,7-dimethoxyphthalazin-1-yl)-4-piperidyl]-1-methyl-urea hydrochloride Formula: C24H30ClN5O3 MolecularWeight: 471.9797

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCN(CC1)C2=NN=CC3=CC(=C(C=C32)OC)OC)C(=O)NCC4=CC=CC=C4.Cl

Isomeric SMILES

CN(C1CCN(CC1)C2=NN=CC3=CC(=C(C=C32)OC)OC)C(=O)NCC4=CC=CC=C4.Cl

InChI

InChI=1S/C24H29N5O3.ClH/c1-28(24(30)25-15-17-7-5-4-6-8-17)19-9-11-29(12-10-19)23-20-14-22(32-3)21(31-2)13-18(20)16-26-27-23;/h4-8,13-14,16,19H,9-12,15H2,1-3H3,(H,25,30);1H