1-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]-4-phenylsulfanyl-butan-1-one

Systemtic Name: 1-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]-4-phenylsulfanyl-butan-1-one Openeye Name: 1-[4-[(5-methyl-2-thienyl)sulfonyl]piperazin-1-yl]-4-phenylsulfanyl-butan-1-one CAS Name: 1-[4-[(5-methyl-2-thiophenyl)sulfonyl]-1-piperazinyl]-4-(phenylthio)-1-butanone IUPAC Name: 1-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]-4-phenylsulfanylbutan-1-one Traditional Name: 1-[4-[(5-methyl-2-thienyl)sulfonyl]piperazino]-4-(phenylthio)butan-1-one Formula: C19H24N2O3S3 MolecularWeight: 424.60046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(=O)CCCSC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(=O)CCCSC3=CC=CC=C3

InChI

InChI=1S/C19H24N2O3S3/c1-16-9-10-19(26-16)27(23,24)21-13-11-20(12-14-21)18(22)8-5-15-25-17-6-3-2-4-7-17/h2-4,6-7,9-10H,5,8,11-15H2,1H3