N-[(1R,2S)-1-(4-ethylpiperazin-1-yl)-1-thiophen-2-yl-propan-2-yl]-2-(4-fluorophenyl)ethanamide

Systemtic Name: N-[(1R,2S)-1-(4-ethylpiperazin-1-yl)-1-thiophen-2-yl-propan-2-yl]-2-(4-fluorophenyl)ethanamide Openeye Name: N-[(1S,2R)-2-(4-ethylpiperazin-1-yl)-1-methyl-2-(2-thienyl)ethyl]-2-(4-fluorophenyl)acetamide CAS Name: N-[(1R,2S)-1-(4-ethyl-1-piperazinyl)-1-thiophen-2-ylpropan-2-yl]-2-(4-fluorophenyl)acetamide IUPAC Name: N-[(1R,2S)-1-(4-ethylpiperazin-1-yl)-1-thiophen-2-ylpropan-2-yl]-2-(4-fluorophenyl)acetamide Traditional Name: N-[(1S,2R)-2-(4-ethylpiperazino)-1-methyl-2-(2-thienyl)ethyl]-2-(4-fluorophenyl)acetamide Formula: C21H28FN3OS MolecularWeight: 389.529923

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(C2=CC=CS2)C(C)NC(=O)CC3=CC=C(C=C3)F

Isomeric SMILES

CCN1CCN(CC1)[C@@H](C2=CC=CS2)[C@H](C)NC(=O)CC3=CC=C(C=C3)F

InChI

InChI=1S/C21H28FN3OS/c1-3-24-10-12-25(13-11-24)21(19-5-4-14-27-19)16(2)23-20(26)15-17-6-8-18(22)9-7-17/h4-9,14,16,21H,3,10-13,15H2,1-2H3,(H,23,26)/t16-,21+/m0/s1