2-butyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3-bis(oxidanylidene)-N-propan-2-yl-isoindole-5-carboxamide

Systemtic Name: 2-butyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3-bis(oxidanylidene)-N-propan-2-yl-isoindole-5-carboxamide Openeye Name: 2-butyl-N-isopropyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-butyl-N-[(1-methyl-4-pyrazolyl)methyl]-1,3-dioxo-N-propan-2-yl-5-isoindolecarboxamide IUPAC Name: 2-butyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3-dioxo-N-propan-2-ylisoindole-5-carboxamide Traditional Name: 2-butyl-N-isopropyl-1,3-diketo-N-[(1-methylpyrazol-4-yl)methyl]isoindoline-5-carboxamide Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N(CC3=CN(N=C3)C)C(C)C

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N(CC3=CN(N=C3)C)C(C)C

InChI

InChI=1S/C21H26N4O3/c1-5-6-9-24-20(27)17-8-7-16(10-18(17)21(24)28)19(26)25(14(2)3)13-15-11-22-23(4)12-15/h7-8,10-12,14H,5-6,9,13H2,1-4H3