1-[4-[(4-tert-butyl-1,3-thiazol-2-yl)methyl]piperazin-1-yl]-3-(4-methoxyphenyl)propan-1-one

Systemtic Name: 1-[4-[(4-tert-butyl-1,3-thiazol-2-yl)methyl]piperazin-1-yl]-3-(4-methoxyphenyl)propan-1-one Openeye Name: 1-[4-[(4-tert-butylthiazol-2-yl)methyl]piperazin-1-yl]-3-(4-methoxyphenyl)propan-1-one CAS Name: 1-[4-[(4-tert-butyl-2-thiazolyl)methyl]-1-piperazinyl]-3-(4-methoxyphenyl)-1-propanone IUPAC Name: 1-[4-[(4-tert-butyl-1,3-thiazol-2-yl)methyl]piperazin-1-yl]-3-(4-methoxyphenyl)propan-1-one Traditional Name: 1-[4-[(4-tert-butylthiazol-2-yl)methyl]piperazino]-3-(4-methoxyphenyl)propan-1-one Formula: C22H31N3O2S MolecularWeight: 401.56544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)CN2CCN(CC2)C(=O)CCC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)CN2CCN(CC2)C(=O)CCC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H31N3O2S/c1-22(2,3)19-16-28-20(23-19)15-24-11-13-25(14-12-24)21(26)10-7-17-5-8-18(27-4)9-6-17/h5-6,8-9,16H,7,10-15H2,1-4H3