1-[4-[(4-methyl-2-oxidanyl-5-propan-2-yl-phenyl)methyl]piperazin-1-yl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone

Systemtic Name: 1-[4-[(4-methyl-2-oxidanyl-5-propan-2-yl-phenyl)methyl]piperazin-1-yl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone Openeye Name: 1-[4-[(2-hydroxy-5-isopropyl-4-methyl-phenyl)methyl]piperazin-1-yl]-2-(4-methylthiazol-2-yl)ethanone CAS Name: 1-[4-[(2-hydroxy-4-methyl-5-propan-2-ylphenyl)methyl]-1-piperazinyl]-2-(4-methyl-2-thiazolyl)ethanone IUPAC Name: 1-[4-[(2-hydroxy-4-methyl-5-propan-2-ylphenyl)methyl]piperazin-1-yl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone Traditional Name: 1-[4-(2-hydroxy-5-isopropyl-4-methyl-benzyl)piperazino]-2-(4-methylthiazol-2-yl)ethanone Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(C)C)CN2CCN(CC2)C(=O)CC3=NC(=CS3)C)O

Isomeric SMILES

CC1=CC(=C(C=C1C(C)C)CN2CCN(CC2)C(=O)CC3=NC(=CS3)C)O

InChI

InChI=1S/C21H29N3O2S/c1-14(2)18-10-17(19(25)9-15(18)3)12-23-5-7-24(8-6-23)21(26)11-20-22-16(4)13-27-20/h9-10,13-14,25H,5-8,11-12H2,1-4H3