N-[3-oxidanylidene-3-[4-(phenylmethyl)sulfonylpiperazin-1-yl]propyl]thiophene-2-sulfonamide

Systemtic Name: N-[3-oxidanylidene-3-[4-(phenylmethyl)sulfonylpiperazin-1-yl]propyl]thiophene-2-sulfonamide Openeye Name: N-[3-(4-benzylsulfonylpiperazin-1-yl)-3-oxo-propyl]thiophene-2-sulfonamide CAS Name: N-[3-oxo-3-[4-(phenylmethyl)sulfonyl-1-piperazinyl]propyl]-2-thiophenesulfonamide IUPAC Name: N-[3-(4-benzylsulfonylpiperazin-1-yl)-3-oxopropyl]thiophene-2-sulfonamide Traditional Name: N-[3-(4-benzylsulfonylpiperazino)-3-keto-propyl]thiophene-2-sulfonamide Formula: C18H23N3O5S3 MolecularWeight: 457.58732

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCNS(=O)(=O)C2=CC=CS2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)CCNS(=O)(=O)C2=CC=CS2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C18H23N3O5S3/c22-17(8-9-19-29(25,26)18-7-4-14-27-18)20-10-12-21(13-11-20)28(23,24)15-16-5-2-1-3-6-16/h1-7,14,19H,8-13,15H2