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

Systemtic Name: 4-[[3-cycloheptyl-4-(4-fluorophenyl)-1,3-thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[[3-cycloheptyl-4-(4-fluorophenyl)thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[3-cycloheptyl-4-(4-fluorophenyl)-2-thiazolylidene]amino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[[3-cycloheptyl-4-(4-fluorophenyl)-1,3-thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[[3-cycloheptyl-4-(4-fluorophenyl)-4-thiazolin-2-ylidene]amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C27H29FN4OS MolecularWeight: 476.608763

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=C(C=C4)F)C5CCCCCC5

Isomeric SMILES

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

InChI

InChI=1S/C27H29FN4OS/c1-19-25(26(33)32(30(19)2)23-12-8-5-9-13-23)29-27-31(22-10-6-3-4-7-11-22)24(18-34-27)20-14-16-21(28)17-15-20/h5,8-9,12-18,22H,3-4,6-7,10-11H2,1-2H3