3-(1,3-benzothiazol-2-yl)-1-[4-(2,4-dichlorophenyl)carbonylpiperazin-1-yl]propan-1-one

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-1-[4-(2,4-dichlorophenyl)carbonylpiperazin-1-yl]propan-1-one Openeye Name: 3-(1,3-benzothiazol-2-yl)-1-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]propan-1-one CAS Name: 3-(1,3-benzothiazol-2-yl)-1-[4-[(2,4-dichlorophenyl)-oxomethyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(1,3-benzothiazol-2-yl)-1-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(1,3-benzothiazol-2-yl)-1-[4-(2,4-dichlorobenzoyl)piperazino]propan-1-one Formula: C21H19Cl2N3O2S MolecularWeight: 448.36546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC2=NC3=CC=CC=C3S2)C(=O)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1CN(CCN1C(=O)CCC2=NC3=CC=CC=C3S2)C(=O)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H19Cl2N3O2S/c22-14-5-6-15(16(23)13-14)21(28)26-11-9-25(10-12-26)20(27)8-7-19-24-17-3-1-2-4-18(17)29-19/h1-6,13H,7-12H2