1-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-2-(2-methoxy-5-methyl-phenyl)ethanone

Systemtic Name: 1-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-2-(2-methoxy-5-methyl-phenyl)ethanone Openeye Name: 1-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-2-(2-methoxy-5-methyl-phenyl)ethanone CAS Name: 1-[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazinyl]-2-(2-methoxy-5-methylphenyl)ethanone IUPAC Name: 1-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-2-(2-methoxy-5-methylphenyl)ethanone Traditional Name: 1-[4-(1,3-benzothiazol-2-ylmethyl)piperazino]-2-(2-methoxy-5-methyl-phenyl)ethanone Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CC(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CC(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H25N3O2S/c1-16-7-8-19(27-2)17(13-16)14-22(26)25-11-9-24(10-12-25)15-21-23-18-5-3-4-6-20(18)28-21/h3-8,13H,9-12,14-15H2,1-2H3