N-[(R)-(4-methoxyphenyl)-phenyl-methyl]-2-(4-thiophen-2-ylcarbonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[(R)-(4-methoxyphenyl)-phenyl-methyl]-2-(4-thiophen-2-ylcarbonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[(R)-(4-methoxyphenyl)-phenyl-methyl]-2-[4-(thiophene-2-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[(R)-(4-methoxyphenyl)-phenylmethyl]-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(R)-(4-methoxyphenyl)-phenylmethyl]-2-[4-(thiophene-2-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-[(R)-(4-methoxyphenyl)-phenyl-methyl]-2-[4-(2-thenoyl)piperazin-1-ium-1-yl]acetamide Formula: C25H28N3O3S+ MolecularWeight: 450.57312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H](C2=CC=CC=C2)NC(=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C25H27N3O3S/c1-31-21-11-9-20(10-12-21)24(19-6-3-2-4-7-19)26-23(29)18-27-13-15-28(16-14-27)25(30)22-8-5-17-32-22/h2-12,17,24H,13-16,18H2,1H3,(H,26,29)/p+1/t24-/m1/s1