(2,5-dimethylphenyl)-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone

Systemtic Name: (2,5-dimethylphenyl)-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Openeye Name: (2,5-dimethylphenyl)-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone CAS Name: (2,5-dimethylphenyl)-[4-(6-methyl-1,3-benzothiazol-2-yl)-1-piperazinyl]methanone IUPAC Name: (2,5-dimethylphenyl)-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: (2,5-dimethylphenyl)-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazino]methanone Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)N2CCN(CC2)C3=NC4=C(S3)C=C(C=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)N2CCN(CC2)C3=NC4=C(S3)C=C(C=C4)C

InChI

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