1-[4-(4,7-dimethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(3-methylphenyl)ethanone

Systemtic Name: 1-[4-(4,7-dimethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(3-methylphenyl)ethanone Openeye Name: 1-[4-(4,7-dimethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(m-tolyl)ethanone CAS Name: 1-[4-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-1-piperazinyl]-2-(3-methylphenyl)ethanone IUPAC Name: 1-[4-(4,7-dimethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(3-methylphenyl)ethanone Traditional Name: 1-[4-(4,7-dimethoxy-1,3-benzothiazol-2-yl)piperazino]-2-(m-tolyl)ethanone Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC(=O)N2CCN(CC2)C3=NC4=C(C=CC(=C4S3)OC)OC

Isomeric SMILES

CC1=CC(=CC=C1)CC(=O)N2CCN(CC2)C3=NC4=C(C=CC(=C4S3)OC)OC

InChI

InChI=1S/C22H25N3O3S/c1-15-5-4-6-16(13-15)14-19(26)24-9-11-25(12-10-24)22-23-20-17(27-2)7-8-18(28-3)21(20)29-22/h4-8,13H,9-12,14H2,1-3H3