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

Systemtic Name: 2-[[4-(2-methylsulfanylphenyl)carbonylpiperazin-1-yl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one Openeye Name: 2-[[4-(2-methylsulfanylbenzoyl)piperazin-1-yl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one CAS Name: 2-[[4-[[2-(methylthio)phenyl]-oxomethyl]-1-piperazinyl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one IUPAC Name: 2-[[4-(2-methylsulfanylbenzoyl)piperazin-1-yl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one Traditional Name: 2-[[4-[2-(methylthio)benzoyl]piperazino]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one Formula: C20H23N3O2S2 MolecularWeight: 401.54552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)N2CCN(CC2)CC3=NC4=C(S3)C(=O)CCC4

Isomeric SMILES

CSC1=CC=CC=C1C(=O)N2CCN(CC2)CC3=NC4=C(S3)C(=O)CCC4

InChI

InChI=1S/C20H23N3O2S2/c1-26-17-8-3-2-5-14(17)20(25)23-11-9-22(10-12-23)13-18-21-15-6-4-7-16(24)19(15)27-18/h2-3,5,8H,4,6-7,9-13H2,1H3