[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]-[(2S)-1-thiophen-2-ylcarbonylpyrrolidin-2-yl]methanone

Systemtic Name: [4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]-[(2S)-1-thiophen-2-ylcarbonylpyrrolidin-2-yl]methanone Openeye Name: [4-[(E)-cinnamyl]piperazin-1-yl]-[(2S)-1-(thiophene-2-carbonyl)pyrrolidin-2-yl]methanone CAS Name: [(2S)-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinyl]-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]methanone IUPAC Name: [4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]-[(2S)-1-(thiophene-2-carbonyl)pyrrolidin-2-yl]methanone Traditional Name: [4-[(E)-cinnamyl]piperazino]-[(2S)-1-(2-thenoyl)pyrrolidin-2-yl]methanone Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O2S/c27-22(20-10-5-13-26(20)23(28)21-11-6-18-29-21)25-16-14-24(15-17-25)12-4-9-19-7-2-1-3-8-19/h1-4,6-9,11,18,20H,5,10,12-17H2/b9-4+/t20-/m0/s1