N-[2-oxidanylidene-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-oxidanylidene-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethyl]thiophene-2-carboxamide Openeye Name: N-[2-(4-benzylsulfonylpiperazin-1-yl)-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[2-oxo-2-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-(4-benzylsulfonylpiperazin-1-yl)-2-oxoethyl]thiophene-2-carboxamide Traditional Name: N-[2-(4-benzylsulfonylpiperazino)-2-keto-ethyl]thiophene-2-carboxamide Formula: C18H21N3O4S2 MolecularWeight: 407.50704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O4S2/c22-17(13-19-18(23)16-7-4-12-26-16)20-8-10-21(11-9-20)27(24,25)14-15-5-2-1-3-6-15/h1-7,12H,8-11,13-14H2,(H,19,23)