N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-1,3-bis(oxidanylidene)-2-(phenylmethyl)isoindole-5-carboxamide

Systemtic Name: N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-1,3-bis(oxidanylidene)-2-(phenylmethyl)isoindole-5-carboxamide Openeye Name: 2-benzyl-N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-[3-(3-methyl-1-phenyl-4-pyrazolyl)propyl]-1,3-dioxo-2-(phenylmethyl)-5-isoindolecarboxamide IUPAC Name: 2-benzyl-N-[3-(3-methyl-1-phenylpyrazol-4-yl)propyl]-1,3-dioxoisoindole-5-carboxamide Traditional Name: 2-benzyl-1,3-diketo-N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]isoindoline-5-carboxamide Formula: C29H26N4O3 MolecularWeight: 478.54174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CCCNC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C=C1CCCNC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H26N4O3/c1-20-23(19-33(31-20)24-12-6-3-7-13-24)11-8-16-30-27(34)22-14-15-25-26(17-22)29(36)32(28(25)35)18-21-9-4-2-5-10-21/h2-7,9-10,12-15,17,19H,8,11,16,18H2,1H3,(H,30,34)