[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]-[(2S)-1-thiophen-2-ylcarbonylpyrrolidin-2-yl]methanone

Systemtic Name: [4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]-[(2S)-1-thiophen-2-ylcarbonylpyrrolidin-2-yl]methanone Openeye Name: [4-[(E)-styryl]sulfonylpiperazin-1-yl]-[(2S)-1-(thiophene-2-carbonyl)pyrrolidin-2-yl]methanone CAS Name: [(2S)-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinyl]-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]methanone IUPAC Name: [4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]-[(2S)-1-(thiophene-2-carbonyl)pyrrolidin-2-yl]methanone Traditional Name: [4-[(E)-styryl]sulfonylpiperazino]-[(2S)-1-(2-thenoyl)pyrrolidin-2-yl]methanone Formula: C22H25N3O4S2 MolecularWeight: 459.5816

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC=CS2)C(=O)N3CCN(CC3)S(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C2=CC=CS2)C(=O)N3CCN(CC3)S(=O)(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C22H25N3O4S2/c26-21(19-8-4-11-25(19)22(27)20-9-5-16-30-20)23-12-14-24(15-13-23)31(28,29)17-10-18-6-2-1-3-7-18/h1-3,5-7,9-10,16-17,19H,4,8,11-15H2/b17-10+/t19-/m0/s1