2-[[4-(2,4,6-trimethylphenyl)carbonylpiperazin-1-yl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one

Systemtic Name: 2-[[4-(2,4,6-trimethylphenyl)carbonylpiperazin-1-yl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one Openeye Name: 2-[[4-(2,4,6-trimethylbenzoyl)piperazin-1-yl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one CAS Name: 2-[[4-[oxo-(2,4,6-trimethylphenyl)methyl]-1-piperazinyl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one IUPAC Name: 2-[[4-(2,4,6-trimethylbenzoyl)piperazin-1-yl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one Traditional Name: 2-[[4-(2,4,6-trimethylbenzoyl)piperazino]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)N2CCN(CC2)CC3=NC4=C(S3)C(=O)CCC4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)N2CCN(CC2)CC3=NC4=C(S3)C(=O)CCC4)C

InChI

InChI=1S/C22H27N3O2S/c1-14-11-15(2)20(16(3)12-14)22(27)25-9-7-24(8-10-25)13-19-23-17-5-4-6-18(26)21(17)28-19/h11-12H,4-10,13H2,1-3H3