3-bromanyl-7-cyclopropyl-2-[[1-(diphenylmethyl)-3,5-dimethyl-pyrazol-4-yl]methyl]-5-methyl-thieno[2,3-d]pyridazin-4-one

Systemtic Name: 3-bromanyl-7-cyclopropyl-2-[[1-(diphenylmethyl)-3,5-dimethyl-pyrazol-4-yl]methyl]-5-methyl-thieno[2,3-d]pyridazin-4-one Openeye Name: 2-[(1-benzhydryl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-bromo-7-cyclopropyl-5-methyl-thieno[2,3-d]pyridazin-4-one CAS Name: 3-bromo-7-cyclopropyl-2-[[1-(diphenylmethyl)-3,5-dimethyl-4-pyrazolyl]methyl]-5-methyl-4-thieno[2,3-d]pyridazinone IUPAC Name: 2-[(1-benzhydryl-3,5-dimethylpyrazol-4-yl)methyl]-3-bromo-7-cyclopropyl-5-methylthieno[2,3-d]pyridazin-4-one Traditional Name: 2-[(1-benzhydryl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-bromo-7-cyclopropyl-5-methyl-thieno[2,3-d]pyridazin-4-one Formula: C29H27BrN4OS MolecularWeight: 559.51988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C2=CC=CC=C2)C3=CC=CC=C3)C)CC4=C(C5=C(S4)C(=NN(C5=O)C)C6CC6)Br

Isomeric SMILES

CC1=C(C(=NN1C(C2=CC=CC=C2)C3=CC=CC=C3)C)CC4=C(C5=C(S4)C(=NN(C5=O)C)C6CC6)Br

InChI

InChI=1S/C29H27BrN4OS/c1-17-22(16-23-25(30)24-28(36-23)26(19-14-15-19)32-33(3)29(24)35)18(2)34(31-17)27(20-10-6-4-7-11-20)21-12-8-5-9-13-21/h4-13,19,27H,14-16H2,1-3H3