N-[2-methyl-5-(2-methylpropanoylamino)phenyl]-1,3-bis(oxidanylidene)-2-(phenylmethyl)isoindole-5-carboxamide

Systemtic Name: N-[2-methyl-5-(2-methylpropanoylamino)phenyl]-1,3-bis(oxidanylidene)-2-(phenylmethyl)isoindole-5-carboxamide Openeye Name: 2-benzyl-N-[2-methyl-5-(2-methylpropanoylamino)phenyl]-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-[2-methyl-5-[(2-methyl-1-oxopropyl)amino]phenyl]-1,3-dioxo-2-(phenylmethyl)-5-isoindolecarboxamide IUPAC Name: 2-benzyl-N-[2-methyl-5-(2-methylpropanoylamino)phenyl]-1,3-dioxoisoindole-5-carboxamide Traditional Name: 2-benzyl-N-[5-(isobutyrylamino)-2-methyl-phenyl]-1,3-diketo-isoindoline-5-carboxamide Formula: C27H25N3O4 MolecularWeight: 455.5051

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)C)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)C)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=CC=C4

InChI

InChI=1S/C27H25N3O4/c1-16(2)24(31)28-20-11-9-17(3)23(14-20)29-25(32)19-10-12-21-22(13-19)27(34)30(26(21)33)15-18-7-5-4-6-8-18/h4-14,16H,15H2,1-3H3,(H,28,31)(H,29,32)