2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanone

Systemtic Name: 2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanone Openeye Name: 2-(3-pyrrolidin-1-ylsulfonylanilino)-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethanone CAS Name: 1-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-2-[3-(1-pyrrolidinylsulfonyl)anilino]ethanone IUPAC Name: 2-(3-pyrrolidin-1-ylsulfonylanilino)-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethanone Traditional Name: 2-(3-pyrrolidinosulfonylanilino)-1-[4-(2-thenoyl)piperazino]ethanone Formula: C21H26N4O4S2 MolecularWeight: 462.58554

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NCC(=O)N3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NCC(=O)N3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C21H26N4O4S2/c26-20(23-10-12-24(13-11-23)21(27)19-7-4-14-30-19)16-22-17-5-3-6-18(15-17)31(28,29)25-8-1-2-9-25/h3-7,14-15,22H,1-2,8-13,16H2