2-cyclohexyl-6-[4-(thiophen-2-ylmethyl)piperazin-1-yl]-3H-isoindol-1-one

Systemtic Name: 2-cyclohexyl-6-[4-(thiophen-2-ylmethyl)piperazin-1-yl]-3H-isoindol-1-one Openeye Name: 2-cyclohexyl-6-[4-(2-thienylmethyl)piperazin-1-yl]isoindolin-1-one CAS Name: 2-cyclohexyl-6-[4-(thiophen-2-ylmethyl)-1-piperazinyl]-3H-isoindol-1-one IUPAC Name: 2-cyclohexyl-6-[4-(thiophen-2-ylmethyl)piperazin-1-yl]-3H-isoindol-1-one Traditional Name: 2-cyclohexyl-6-[4-(2-thenyl)piperazino]isoindolin-1-one Formula: C23H29N3OS MolecularWeight: 395.56086

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CC5=CC=CS5

Isomeric SMILES

C1CCC(CC1)N2CC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CC5=CC=CS5

InChI

InChI=1S/C23H29N3OS/c27-23-22-15-20(9-8-18(22)16-26(23)19-5-2-1-3-6-19)25-12-10-24(11-13-25)17-21-7-4-14-28-21/h4,7-9,14-15,19H,1-3,5-6,10-13,16-17H2