(4Z)-5-methyl-4-[1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]ethylidene]-2-phenyl-pyrazol-3-one

Systemtic Name: (4Z)-5-methyl-4-[1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]ethylidene]-2-phenyl-pyrazol-3-one Openeye Name: (4Z)-5-methyl-4-[1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]ethylidene]-2-phenyl-pyrazol-3-one CAS Name: (4Z)-5-methyl-4-[1-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]ethylidene]-2-phenyl-3-pyrazolone IUPAC Name: (4Z)-5-methyl-4-[1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]ethylidene]-2-phenylpyrazol-3-one Traditional Name: (4Z)-5-methyl-4-[1-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]ethylidene]-2-phenyl-2-pyrazolin-3-one Formula: C19H23N5OS MolecularWeight: 369.48382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCCNC(=C2C(=NN(C2=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CC1=C(N=CN1)CSCCN/C(=C\2/C(=NN(C2=O)C3=CC=CC=C3)C)/C

InChI

InChI=1S/C19H23N5OS/c1-13-17(22-12-21-13)11-26-10-9-20-14(2)18-15(3)23-24(19(18)25)16-7-5-4-6-8-16/h4-8,12,20H,9-11H2,1-3H3,(H,21,22)/b18-14-