1,5-dimethyl-4-[[4-methyl-3-(5-methylhexan-2-yl)-1,3-thiazol-2-ylidene]amino]-2-phenyl-pyrazol-3-one

Systemtic Name: 1,5-dimethyl-4-[[4-methyl-3-(5-methylhexan-2-yl)-1,3-thiazol-2-ylidene]amino]-2-phenyl-pyrazol-3-one Openeye Name: 4-[[3-(1,4-dimethylpentyl)-4-methyl-thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 1,5-dimethyl-4-[[4-methyl-3-(5-methylhexan-2-yl)-2-thiazolylidene]amino]-2-phenyl-3-pyrazolone IUPAC Name: 1,5-dimethyl-4-[[4-methyl-3-(5-methylhexan-2-yl)-1,3-thiazol-2-ylidene]amino]-2-phenylpyrazol-3-one Traditional Name: 4-[[3-(1,4-dimethylpentyl)-4-methyl-4-thiazolin-2-ylidene]amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C22H30N4OS MolecularWeight: 398.5648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)N1C(C)CCC(C)C

Isomeric SMILES

CC1=CSC(=NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)N1C(C)CCC(C)C

InChI

InChI=1S/C22H30N4OS/c1-15(2)12-13-16(3)25-17(4)14-28-22(25)23-20-18(5)24(6)26(21(20)27)19-10-8-7-9-11-19/h7-11,14-16H,12-13H2,1-6H3