N-[1-(3,4-dichlorophenyl)-3-piperazin-1-yl-propan-2-yl]-1,2-benzothiazole-3-carboxamide

Systemtic Name: N-[1-(3,4-dichlorophenyl)-3-piperazin-1-yl-propan-2-yl]-1,2-benzothiazole-3-carboxamide Openeye Name: N-[1-[(3,4-dichlorophenyl)methyl]-2-piperazin-1-yl-ethyl]-1,2-benzothiazole-3-carboxamide CAS Name: N-[1-(3,4-dichlorophenyl)-3-(1-piperazinyl)propan-2-yl]-1,2-benzothiazole-3-carboxamide IUPAC Name: N-[1-(3,4-dichlorophenyl)-3-piperazin-1-ylpropan-2-yl]-1,2-benzothiazole-3-carboxamide Traditional Name: N-[1-(3,4-dichlorobenzyl)-2-piperazino-ethyl]-1,2-benzothiazole-3-carboxamide Formula: C21H22Cl2N4OS MolecularWeight: 449.39658

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC(CC2=CC(=C(C=C2)Cl)Cl)NC(=O)C3=NSC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1)CC(CC2=CC(=C(C=C2)Cl)Cl)NC(=O)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C21H22Cl2N4OS/c22-17-6-5-14(12-18(17)23)11-15(13-27-9-7-24-8-10-27)25-21(28)20-16-3-1-2-4-19(16)29-26-20/h1-6,12,15,24H,7-11,13H2,(H,25,28)