2-butyl-2-(4-isoquinolin-3-ylpiperazin-1-yl)-5-(4-methoxyphenyl)-1,3-thiazolidin-4-one

Systemtic Name: 2-butyl-2-(4-isoquinolin-3-ylpiperazin-1-yl)-5-(4-methoxyphenyl)-1,3-thiazolidin-4-one Openeye Name: 2-butyl-2-[4-(3-isoquinolyl)piperazin-1-yl]-5-(4-methoxyphenyl)thiazolidin-4-one CAS Name: 2-butyl-2-[4-(3-isoquinolinyl)-1-piperazinyl]-5-(4-methoxyphenyl)-4-thiazolidinone IUPAC Name: 2-butyl-2-(4-isoquinolin-3-ylpiperazin-1-yl)-5-(4-methoxyphenyl)-1,3-thiazolidin-4-one Traditional Name: 2-butyl-2-[4-(3-isoquinolyl)piperazino]-5-(4-methoxyphenyl)thiazolidin-4-one Formula: C27H32N4O2S MolecularWeight: 476.63358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(NC(=O)C(S1)C2=CC=C(C=C2)OC)N3CCN(CC3)C4=CC5=CC=CC=C5C=N4

Isomeric SMILES

CCCCC1(NC(=O)C(S1)C2=CC=C(C=C2)OC)N3CCN(CC3)C4=CC5=CC=CC=C5C=N4

InChI

InChI=1S/C27H32N4O2S/c1-3-4-13-27(29-26(32)25(34-27)20-9-11-23(33-2)12-10-20)31-16-14-30(15-17-31)24-18-21-7-5-6-8-22(21)19-28-24/h5-12,18-19,25H,3-4,13-17H2,1-2H3,(H,29,32)