(3,4-dimethylphenyl)-[4-(4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone

Systemtic Name: (3,4-dimethylphenyl)-[4-(4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Openeye Name: (3,4-dimethylphenyl)-[4-(4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone CAS Name: (3,4-dimethylphenyl)-[4-(4-methyl-1,3-benzothiazol-2-yl)-1-piperazinyl]methanone IUPAC Name: (3,4-dimethylphenyl)-[4-(4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: (3,4-dimethylphenyl)-[4-(4-methyl-1,3-benzothiazol-2-yl)piperazino]methanone Formula: C21H23N3OS MolecularWeight: 365.49182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4=CC(=C(C=C4)C)C

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4=CC(=C(C=C4)C)C

InChI

InChI=1S/C21H23N3OS/c1-14-7-8-17(13-16(14)3)20(25)23-9-11-24(12-10-23)21-22-19-15(2)5-4-6-18(19)26-21/h4-8,13H,9-12H2,1-3H3