2-oxidanyl-6-propan-2-yl-3-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2-oxidanyl-6-propan-2-yl-3-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]cyclohepta-2,4,6-trien-1-one Openeye Name: 2-hydroxy-6-isopropyl-3-[(4-thiazol-2-ylpiperazin-1-yl)methyl]cyclohepta-2,4,6-trien-1-one CAS Name: 2-hydroxy-6-propan-2-yl-3-[[4-(2-thiazolyl)-1-piperazinyl]methyl]-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-hydroxy-6-propan-2-yl-3-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]cyclohepta-2,4,6-trien-1-one Traditional Name: 2-hydroxy-6-isopropyl-3-[(4-thiazol-2-ylpiperazino)methyl]cyclohepta-2,4,6-trien-1-one Formula: C18H23N3O2S MolecularWeight: 345.45912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=O)C(=C(C=C1)CN2CCN(CC2)C3=NC=CS3)O

Isomeric SMILES

CC(C)C1=CC(=O)C(=C(C=C1)CN2CCN(CC2)C3=NC=CS3)O

InChI

InChI=1S/C18H23N3O2S/c1-13(2)14-3-4-15(17(23)16(22)11-14)12-20-6-8-21(9-7-20)18-19-5-10-24-18/h3-5,10-11,13H,6-9,12H2,1-2H3,(H,22,23)