N-cycloheptyl-3-oxidanylidene-2-[3-(4-propylpiperazin-1-yl)propyl]-1H-isoindole-1-carboxamide

Systemtic Name: N-cycloheptyl-3-oxidanylidene-2-[3-(4-propylpiperazin-1-yl)propyl]-1H-isoindole-1-carboxamide Openeye Name: N-cycloheptyl-3-oxo-2-[3-(4-propylpiperazin-1-yl)propyl]isoindoline-1-carboxamide CAS Name: N-cycloheptyl-3-oxo-2-[3-(4-propyl-1-piperazinyl)propyl]-1H-isoindole-1-carboxamide IUPAC Name: N-cycloheptyl-3-oxo-2-[3-(4-propylpiperazin-1-yl)propyl]-1H-isoindole-1-carboxamide Traditional Name: N-cycloheptyl-3-keto-2-[3-(4-propylpiperazino)propyl]isoindoline-1-carboxamide Formula: C26H40N4O2 MolecularWeight: 440.6214

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)CCCN2C(C3=CC=CC=C3C2=O)C(=O)NC4CCCCCC4

Isomeric SMILES

CCCN1CCN(CC1)CCCN2C(C3=CC=CC=C3C2=O)C(=O)NC4CCCCCC4

InChI

InChI=1S/C26H40N4O2/c1-2-14-28-17-19-29(20-18-28)15-9-16-30-24(22-12-7-8-13-23(22)26(30)32)25(31)27-21-10-5-3-4-6-11-21/h7-8,12-13,21,24H,2-6,9-11,14-20H2,1H3,(H,27,31)