2-[4-methylsulfonyl-1-oxidanylidene-1-(4-propylpiperazin-1-yl)butan-2-yl]-3H-isoindol-1-one

Systemtic Name: 2-[4-methylsulfonyl-1-oxidanylidene-1-(4-propylpiperazin-1-yl)butan-2-yl]-3H-isoindol-1-one Openeye Name: 2-[3-methylsulfonyl-1-(4-propylpiperazine-1-carbonyl)propyl]isoindolin-1-one CAS Name: 2-[4-methylsulfonyl-1-oxo-1-(4-propyl-1-piperazinyl)butan-2-yl]-3H-isoindol-1-one IUPAC Name: 2-[4-methylsulfonyl-1-oxo-1-(4-propylpiperazin-1-yl)butan-2-yl]-3H-isoindol-1-one Traditional Name: 2-[3-mesyl-1-(4-propylpiperazine-1-carbonyl)propyl]isoindolin-1-one Formula: C20H29N3O4S MolecularWeight: 407.52696

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C(=O)C(CCS(=O)(=O)C)N2CC3=CC=CC=C3C2=O

Isomeric SMILES

CCCN1CCN(CC1)C(=O)C(CCS(=O)(=O)C)N2CC3=CC=CC=C3C2=O

InChI

InChI=1S/C20H29N3O4S/c1-3-9-21-10-12-22(13-11-21)20(25)18(8-14-28(2,26)27)23-15-16-6-4-5-7-17(16)19(23)24/h4-7,18H,3,8-15H2,1-2H3