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

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-1-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 3-(1,3-benzothiazol-2-yl)-1-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]propan-1-one CAS Name: 3-(1,3-benzothiazol-2-yl)-1-[4-(3,4-dichlorophenyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 3-(1,3-benzothiazol-2-yl)-1-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 3-(1,3-benzothiazol-2-yl)-1-[4-(3,4-dichlorophenyl)sulfonylpiperazino]propan-1-one Formula: C20H19Cl2N3O3S2 MolecularWeight: 484.41916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19Cl2N3O3S2/c21-15-6-5-14(13-16(15)22)30(27,28)25-11-9-24(10-12-25)20(26)8-7-19-23-17-3-1-2-4-18(17)29-19/h1-6,13H,7-12H2