4-[(E)-(1-butan-2-yl-3-methyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[(E)-(1-butan-2-yl-3-methyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 1,5-dimethyl-4-[(E)-(3-methyl-5-oxo-1-sec-butyl-2-thioxo-imidazolidin-4-ylidene)methyl]-2-phenyl-pyrazol-3-one CAS Name: 4-[(E)-(1-butan-2-yl-3-methyl-5-oxo-2-sulfanylidene-4-imidazolidinylidene)methyl]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[(E)-(1-butan-2-yl-3-methyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[(E)-(5-keto-3-methyl-1-sec-butyl-2-thioxo-imidazolidin-4-ylidene)methyl]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C20H24N4O2S MolecularWeight: 384.49516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C(=CC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)N(C1=S)C

Isomeric SMILES

CCC(C)N1C(=O)/C(=C\C2=C(N(N(C2=O)C3=CC=CC=C3)C)C)/N(C1=S)C

InChI

InChI=1S/C20H24N4O2S/c1-6-13(2)23-19(26)17(21(4)20(23)27)12-16-14(3)22(5)24(18(16)25)15-10-8-7-9-11-15/h7-13H,6H2,1-5H3/b17-12+