3-naphthalen-2-ylsulfonyl-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-naphthalen-2-ylsulfonyl-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propan-1-one Openeye Name: 3-(2-naphthylsulfonyl)-1-[4-(2-thienylsulfonyl)piperazin-1-yl]propan-1-one CAS Name: 3-(2-naphthalenylsulfonyl)-1-(4-thiophen-2-ylsulfonyl-1-piperazinyl)-1-propanone IUPAC Name: 3-naphthalen-2-ylsulfonyl-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propan-1-one Traditional Name: 3-(2-naphthylsulfonyl)-1-[4-(2-thienylsulfonyl)piperazino]propan-1-one Formula: C21H22N2O5S3 MolecularWeight: 478.60478

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCS(=O)(=O)C2=CC3=CC=CC=C3C=C2)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)CCS(=O)(=O)C2=CC3=CC=CC=C3C=C2)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H22N2O5S3/c24-20(22-10-12-23(13-11-22)31(27,28)21-6-3-14-29-21)9-15-30(25,26)19-8-7-17-4-1-2-5-18(17)16-19/h1-8,14,16H,9-13,15H2