N-[(1S)-1-(3,4-dichlorophenyl)ethyl]-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[(1S)-1-(3,4-dichlorophenyl)ethyl]-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-[(1S)-1-(3,4-dichlorophenyl)ethyl]benzamide CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]-N-[(1S)-1-(3,4-dichlorophenyl)ethyl]benzamide IUPAC Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-[(1S)-1-(3,4-dichlorophenyl)ethyl]benzamide Traditional Name: 3-(4-acetylpiperazino)sulfonyl-N-[(1S)-1-(3,4-dichlorophenyl)ethyl]benzamide Formula: C21H23Cl2N3O4S MolecularWeight: 484.39602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)Cl)Cl)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C(=O)C

Isomeric SMILES

C[C@@H](C1=CC(=C(C=C1)Cl)Cl)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C(=O)C

InChI

InChI=1S/C21H23Cl2N3O4S/c1-14(16-6-7-19(22)20(23)13-16)24-21(28)17-4-3-5-18(12-17)31(29,30)26-10-8-25(9-11-26)15(2)27/h3-7,12-14H,8-11H2,1-2H3,(H,24,28)/t14-/m0/s1