4-(4-chlorophenyl)sulfanyl-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)butan-1-one

Systemtic Name: 4-(4-chlorophenyl)sulfanyl-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)butan-1-one Openeye Name: 4-(4-chlorophenyl)sulfanyl-1-[4-(2-thienylsulfonyl)piperazin-1-yl]butan-1-one CAS Name: 4-[(4-chlorophenyl)thio]-1-(4-thiophen-2-ylsulfonyl-1-piperazinyl)-1-butanone IUPAC Name: 4-(4-chlorophenyl)sulfanyl-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)butan-1-one Traditional Name: 4-[(4-chlorophenyl)thio]-1-[4-(2-thienylsulfonyl)piperazino]butan-1-one Formula: C18H21ClN2O3S3 MolecularWeight: 445.01894

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCSC2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCN1C(=O)CCCSC2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H21ClN2O3S3/c19-15-5-7-16(8-6-15)25-13-1-3-17(22)20-9-11-21(12-10-20)27(23,24)18-4-2-14-26-18/h2,4-8,14H,1,3,9-13H2