1-[1-diazanyl-4-[(4-methoxyphenyl)methyl]phthalazin-5-yl]oxy-3-(propan-2-ylamino)propan-2-ol sulfate

Systemtic Name: 1-[1-diazanyl-4-[(4-methoxyphenyl)methyl]phthalazin-5-yl]oxy-3-(propan-2-ylamino)propan-2-ol sulfate Openeye Name: 1-[1-hydrazino-4-[(4-methoxyphenyl)methyl]phthalazin-5-yl]oxy-3-(isopropylamino)propan-2-ol sulfate CAS Name: 1-[[1-hydrazinyl-4-[(4-methoxyphenyl)methyl]-5-phthalazinyl]oxy]-3-(propan-2-ylamino)-2-propanol sulfate IUPAC Name: 1-[1-hydrazinyl-4-[(4-methoxyphenyl)methyl]phthalazin-5-yl]oxy-3-(propan-2-ylamino)propan-2-ol sulfate Traditional Name: 1-(1-hydrazino-4-p-anisyl-phthalazin-5-yl)oxy-3-(isopropylamino)propan-2-ol sulfate Formula: C22H29N5O7S-2 MolecularWeight: 507.55996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=CC=CC2=C1C(=NN=C2NN)CC3=CC=C(C=C3)OC)O.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CC(C)NCC(COC1=CC=CC2=C1C(=NN=C2NN)CC3=CC=C(C=C3)OC)O.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C22H29N5O3.H2O4S/c1-14(2)24-12-16(28)13-30-20-6-4-5-18-21(20)19(26-27-22(18)25-23)11-15-7-9-17(29-3)10-8-15;1-5(2,3)4/h4-10,14,16,24,28H,11-13,23H2,1-3H3,(H,25,27);(H2,1,2,3,4)/p-2