4-[3-(1,3-benzothiazol-2-yl)propanoyl]-6-methyl-1-(2-methylphenyl)piperazin-2-one

Systemtic Name: 4-[3-(1,3-benzothiazol-2-yl)propanoyl]-6-methyl-1-(2-methylphenyl)piperazin-2-one Openeye Name: 4-[3-(1,3-benzothiazol-2-yl)propanoyl]-6-methyl-1-(o-tolyl)piperazin-2-one CAS Name: 4-[3-(1,3-benzothiazol-2-yl)-1-oxopropyl]-6-methyl-1-(2-methylphenyl)-2-piperazinone IUPAC Name: 4-[3-(1,3-benzothiazol-2-yl)propanoyl]-6-methyl-1-(2-methylphenyl)piperazin-2-one Traditional Name: 4-[3-(1,3-benzothiazol-2-yl)propanoyl]-6-methyl-1-(o-tolyl)piperazin-2-one Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(=O)N1C2=CC=CC=C2C)C(=O)CCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1CN(CC(=O)N1C2=CC=CC=C2C)C(=O)CCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H23N3O2S/c1-15-7-3-5-9-18(15)25-16(2)13-24(14-22(25)27)21(26)12-11-20-23-17-8-4-6-10-19(17)28-20/h3-10,16H,11-14H2,1-2H3