1-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)urea

Systemtic Name: 1-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)urea Openeye Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-[(1,3-dioxoisoindolin-2-yl)methyl]urea CAS Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-[(1,3-dioxo-2-isoindolyl)methyl]urea IUPAC Name: 1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-[(1,3-dioxoisoindol-2-yl)methyl]urea Traditional Name: 1-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-3-(phthalimidomethyl)urea Formula: C21H19N5O4 MolecularWeight: 405.40666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)NCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)NCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H19N5O4/c1-13-17(20(29)26(24(13)2)14-8-4-3-5-9-14)23-21(30)22-12-25-18(27)15-10-6-7-11-16(15)19(25)28/h3-11H,12H2,1-2H3,(H2,22,23,30)