4-[2-[4-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]piperidin-1-yl]-2-oxidanylidene-ethyl]-2H-phthalazin-1-one

Systemtic Name: 4-[2-[4-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]piperidin-1-yl]-2-oxidanylidene-ethyl]-2H-phthalazin-1-one Openeye Name: 4-[2-[4-[4-(4-bromophenyl)-5-methyl-thiazol-2-yl]-1-piperidyl]-2-oxo-ethyl]-2H-phthalazin-1-one CAS Name: 4-[2-[4-[4-(4-bromophenyl)-5-methyl-2-thiazolyl]-1-piperidinyl]-2-oxoethyl]-2H-phthalazin-1-one IUPAC Name: 4-[2-[4-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]piperidin-1-yl]-2-oxoethyl]-2H-phthalazin-1-one Traditional Name: 4-[2-[4-[4-(4-bromophenyl)-5-methyl-thiazol-2-yl]piperidino]-2-keto-ethyl]-2H-phthalazin-1-one Formula: C25H23BrN4O2S MolecularWeight: 523.44472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)C2CCN(CC2)C(=O)CC3=NNC(=O)C4=CC=CC=C43)C5=CC=C(C=C5)Br

Isomeric SMILES

CC1=C(N=C(S1)C2CCN(CC2)C(=O)CC3=NNC(=O)C4=CC=CC=C43)C5=CC=C(C=C5)Br

InChI

InChI=1S/C25H23BrN4O2S/c1-15-23(16-6-8-18(26)9-7-16)27-25(33-15)17-10-12-30(13-11-17)22(31)14-21-19-4-2-3-5-20(19)24(32)29-28-21/h2-9,17H,10-14H2,1H3,(H,29,32)