3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1-ethyl-1-phenyl-thiourea

Systemtic Name: 3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1-ethyl-1-phenyl-thiourea Openeye Name: 3-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-1-ethyl-1-phenyl-thiourea CAS Name: 3-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-1-ethyl-1-phenylthiourea IUPAC Name: 3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1-ethyl-1-phenylthiourea Traditional Name: 1-ethyl-3-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-1-phenyl-thiourea Formula: C20H22N4OS MolecularWeight: 366.47988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=S)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=S)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C

InChI

InChI=1S/C20H22N4OS/c1-4-23(16-11-7-5-8-12-16)20(26)21-18-15(2)22(3)24(19(18)25)17-13-9-6-10-14-17/h5-14H,4H2,1-3H3,(H,21,26)