3-(3-chloranyl-4-methyl-phenyl)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(3-chloranyl-4-methyl-phenyl)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propan-1-one Openeye Name: 3-(3-chloro-4-methyl-phenyl)-1-[4-(2-thienylsulfonyl)piperazin-1-yl]propan-1-one CAS Name: 3-(3-chloro-4-methylphenyl)-1-(4-thiophen-2-ylsulfonyl-1-piperazinyl)-1-propanone IUPAC Name: 3-(3-chloro-4-methylphenyl)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propan-1-one Traditional Name: 3-(3-chloro-4-methyl-phenyl)-1-[4-(2-thienylsulfonyl)piperazino]propan-1-one Formula: C18H21ClN2O3S2 MolecularWeight: 412.95394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3)Cl

InChI

InChI=1S/C18H21ClN2O3S2/c1-14-4-5-15(13-16(14)19)6-7-17(22)20-8-10-21(11-9-20)26(23,24)18-3-2-12-25-18/h2-5,12-13H,6-11H2,1H3