(3Z)-1-tert-butyl-3-[3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]isoindol-1-ylidene]urea

Systemtic Name: (3Z)-1-tert-butyl-3-[3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]isoindol-1-ylidene]urea Openeye Name: (3Z)-1-tert-butyl-3-[3-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]isoindol-1-ylidene]urea CAS Name: (3Z)-1-tert-butyl-3-[3-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-1-isoindolylidene]urea IUPAC Name: (3Z)-1-tert-butyl-3-[3-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]isoindol-1-ylidene]urea Traditional Name: (3Z)-1-tert-butyl-3-[3-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]isoindol-1-ylidene]urea Formula: C24H26N6O2 MolecularWeight: 430.50224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=NC(=NC(=O)NC(C)(C)C)C4=CC=CC=C43

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=N/C(=N\C(=O)NC(C)(C)C)/C4=CC=CC=C43

InChI

InChI=1S/C24H26N6O2/c1-15-19(22(31)30(29(15)5)16-11-7-6-8-12-16)25-20-17-13-9-10-14-18(17)21(26-20)27-23(32)28-24(2,3)4/h6-14H,1-5H3,(H2,25,26,27,28,32)