[4-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(3,5-dimethylphenyl)methanone

Systemtic Name: [4-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(3,5-dimethylphenyl)methanone Openeye Name: [4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(3,5-dimethylphenyl)methanone CAS Name: [4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-(3,5-dimethylphenyl)methanone IUPAC Name: [4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(3,5-dimethylphenyl)methanone Traditional Name: [4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)piperazino]-(3,5-dimethylphenyl)methanone Formula: C21H22ClN3OS MolecularWeight: 399.93688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22ClN3OS/c1-13-10-14(2)12-16(11-13)20(26)24-6-8-25(9-7-24)21-23-18-15(3)4-5-17(22)19(18)27-21/h4-5,10-12H,6-9H2,1-3H3