2-[(3-bromanyl-4-methoxy-phenyl)methylamino]-6-(4-methyl-1,3-thiazol-2-yl)-1-phthalazin-1-yl-piperidin-4-ol

Systemtic Name: 2-[(3-bromanyl-4-methoxy-phenyl)methylamino]-6-(4-methyl-1,3-thiazol-2-yl)-1-phthalazin-1-yl-piperidin-4-ol Openeye Name: 2-[(3-bromo-4-methoxy-phenyl)methylamino]-6-(4-methylthiazol-2-yl)-1-phthalazin-1-yl-piperidin-4-ol CAS Name: 2-[(3-bromo-4-methoxyphenyl)methylamino]-6-(4-methyl-2-thiazolyl)-1-(1-phthalazinyl)-4-piperidinol IUPAC Name: 2-[(3-bromo-4-methoxyphenyl)methylamino]-6-(4-methyl-1,3-thiazol-2-yl)-1-phthalazin-1-ylpiperidin-4-ol Traditional Name: 2-[(3-bromo-4-methoxy-benzyl)amino]-6-(4-methylthiazol-2-yl)-1-phthalazin-1-yl-piperidin-4-ol Formula: C25H26BrN5O2S MolecularWeight: 540.47524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C2CC(CC(N2C3=NN=CC4=CC=CC=C43)NCC5=CC(=C(C=C5)OC)Br)O

Isomeric SMILES

CC1=CSC(=N1)C2CC(CC(N2C3=NN=CC4=CC=CC=C43)NCC5=CC(=C(C=C5)OC)Br)O

InChI

InChI=1S/C25H26BrN5O2S/c1-15-14-34-25(29-15)21-10-18(32)11-23(27-12-16-7-8-22(33-2)20(26)9-16)31(21)24-19-6-4-3-5-17(19)13-28-30-24/h3-9,13-14,18,21,23,27,32H,10-12H2,1-2H3