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

Systemtic Name: 3-(2,4-dichlorophenyl)-1-[4-(3-ethanoylphenyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 1-[4-(3-acetylphenyl)sulfonylpiperazin-1-yl]-3-(2,4-dichlorophenyl)propan-1-one CAS Name: 1-[4-(3-acetylphenyl)sulfonyl-1-piperazinyl]-3-(2,4-dichlorophenyl)-1-propanone IUPAC Name: 1-[4-(3-acetylphenyl)sulfonylpiperazin-1-yl]-3-(2,4-dichlorophenyl)propan-1-one Traditional Name: 1-[4-(3-acetylphenyl)sulfonylpiperazino]-3-(2,4-dichlorophenyl)propan-1-one Formula: C21H22Cl2N2O4S MolecularWeight: 469.38138

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H22Cl2N2O4S/c1-15(26)17-3-2-4-19(13-17)30(28,29)25-11-9-24(10-12-25)21(27)8-6-16-5-7-18(22)14-20(16)23/h2-5,7,13-14H,6,8-12H2,1H3