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

Systemtic Name: 4-[[4-(2-bromophenyl)-3-(4-methylpentan-2-ylideneamino)-1,3-thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[[4-(2-bromophenyl)-3-(1,3-dimethylbutylideneamino)thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[4-(2-bromophenyl)-3-(4-methylpentan-2-ylideneamino)-2-thiazolylidene]amino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[[4-(2-bromophenyl)-3-(4-methylpentan-2-ylideneamino)-1,3-thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[[4-(2-bromophenyl)-3-(1,3-dimethylbutylideneamino)-4-thiazolin-2-ylidene]amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C26H28BrN5OS MolecularWeight: 538.50242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28BrN5OS/c1-17(2)15-18(3)29-31-23(21-13-9-10-14-22(21)27)16-34-26(31)28-24-19(4)30(5)32(25(24)33)20-11-7-6-8-12-20/h6-14,16-17H,15H2,1-5H3