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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22ClN3OS/c1-14-4-3-5-16(12-14)13-18(26)24-8-10-25(11-9-24)21-23-19-15(2)6-7-17(22)20(19)27-21/h3-7,12H,8-11,13H2,1-2H3