3-methoxy-N-[(1S,2R)-1-(4-phenylpiperazin-1-ium-1-yl)-1-thiophen-2-yl-propan-2-yl]benzamide

Systemtic Name: 3-methoxy-N-[(1S,2R)-1-(4-phenylpiperazin-1-ium-1-yl)-1-thiophen-2-yl-propan-2-yl]benzamide Openeye Name: 3-methoxy-N-[(1R,2S)-1-methyl-2-(4-phenylpiperazin-1-ium-1-yl)-2-(2-thienyl)ethyl]benzamide CAS Name: 3-methoxy-N-[(1S,2R)-1-(4-phenyl-1-piperazin-1-iumyl)-1-thiophen-2-ylpropan-2-yl]benzamide IUPAC Name: 3-methoxy-N-[(1S,2R)-1-(4-phenylpiperazin-1-ium-1-yl)-1-thiophen-2-ylpropan-2-yl]benzamide Traditional Name: 3-methoxy-N-[(1R,2S)-1-methyl-2-(4-phenylpiperazin-1-ium-1-yl)-2-(2-thienyl)ethyl]benzamide Formula: C25H30N3O2S+ MolecularWeight: 436.5896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CS1)[NH+]2CCN(CC2)C3=CC=CC=C3)NC(=O)C4=CC(=CC=C4)OC

Isomeric SMILES

C[C@H]([C@@H](C1=CC=CS1)[NH+]2CCN(CC2)C3=CC=CC=C3)NC(=O)C4=CC(=CC=C4)OC

InChI

InChI=1S/C25H29N3O2S/c1-19(26-25(29)20-8-6-11-22(18-20)30-2)24(23-12-7-17-31-23)28-15-13-27(14-16-28)21-9-4-3-5-10-21/h3-12,17-19,24H,13-16H2,1-2H3,(H,26,29)/p+1/t19-,24+/m1/s1