4-[[4-(2-bromophenyl)-3-cycloheptyl-1,3-thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[[4-(2-bromophenyl)-3-cycloheptyl-1,3-thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[[4-(2-bromophenyl)-3-cycloheptyl-thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[4-(2-bromophenyl)-3-cycloheptyl-2-thiazolylidene]amino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[[4-(2-bromophenyl)-3-cycloheptyl-1,3-thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[[4-(2-bromophenyl)-3-cycloheptyl-4-thiazolin-2-ylidene]amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C27H29BrN4OS MolecularWeight: 537.51436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=C3N(C(=CS3)C4=CC=CC=C4Br)C5CCCCCC5

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=C3N(C(=CS3)C4=CC=CC=C4Br)C5CCCCCC5

InChI

InChI=1S/C27H29BrN4OS/c1-19-25(26(33)32(30(19)2)21-14-8-5-9-15-21)29-27-31(20-12-6-3-4-7-13-20)24(18-34-27)22-16-10-11-17-23(22)28/h5,8-11,14-18,20H,3-4,6-7,12-13H2,1-2H3