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

Systemtic Name: 3-bromanyl-7-cyclopropyl-2-[[1-(diphenylmethyl)-3,5-dimethyl-pyrazol-4-yl]methyl]-5-ethyl-thieno[2,3-d]pyridazin-4-one Openeye Name: 2-[(1-benzhydryl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-bromo-7-cyclopropyl-5-ethyl-thieno[2,3-d]pyridazin-4-one CAS Name: 3-bromo-7-cyclopropyl-2-[[1-(diphenylmethyl)-3,5-dimethyl-4-pyrazolyl]methyl]-5-ethyl-4-thieno[2,3-d]pyridazinone IUPAC Name: 2-[(1-benzhydryl-3,5-dimethylpyrazol-4-yl)methyl]-3-bromo-7-cyclopropyl-5-ethylthieno[2,3-d]pyridazin-4-one Traditional Name: 2-[(1-benzhydryl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-bromo-7-cyclopropyl-5-ethyl-thieno[2,3-d]pyridazin-4-one Formula: C30H29BrN4OS MolecularWeight: 573.54646

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C(=N1)C3CC3)SC(=C2Br)CC4=C(N(N=C4C)C(C5=CC=CC=C5)C6=CC=CC=C6)C

Isomeric SMILES

CCN1C(=O)C2=C(C(=N1)C3CC3)SC(=C2Br)CC4=C(N(N=C4C)C(C5=CC=CC=C5)C6=CC=CC=C6)C

InChI

InChI=1S/C30H29BrN4OS/c1-4-34-30(36)25-26(31)24(37-29(25)27(33-34)20-15-16-20)17-23-18(2)32-35(19(23)3)28(21-11-7-5-8-12-21)22-13-9-6-10-14-22/h5-14,20,28H,4,15-17H2,1-3H3