N-[1-(3-methylphenyl)-3-piperazin-1-yl-propan-2-yl]-1,2-benzothiazole-3-carboxamide

Systemtic Name: N-[1-(3-methylphenyl)-3-piperazin-1-yl-propan-2-yl]-1,2-benzothiazole-3-carboxamide Openeye Name: N-[1-(m-tolylmethyl)-2-piperazin-1-yl-ethyl]-1,2-benzothiazole-3-carboxamide CAS Name: N-[1-(3-methylphenyl)-3-(1-piperazinyl)propan-2-yl]-1,2-benzothiazole-3-carboxamide IUPAC Name: N-[1-(3-methylphenyl)-3-piperazin-1-ylpropan-2-yl]-1,2-benzothiazole-3-carboxamide Traditional Name: N-[1-(3-methylbenzyl)-2-piperazino-ethyl]-1,2-benzothiazole-3-carboxamide Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC(CN2CCNCC2)NC(=O)C3=NSC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=CC=C1)CC(CN2CCNCC2)NC(=O)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C22H26N4OS/c1-16-5-4-6-17(13-16)14-18(15-26-11-9-23-10-12-26)24-22(27)21-19-7-2-3-8-20(19)28-25-21/h2-8,13,18,23H,9-12,14-15H2,1H3,(H,24,27)