N-[(1R,2R)-1-(4-phenylpiperazin-1-ium-1-yl)-1-thiophen-2-yl-propan-2-yl]cyclohexanecarboxamide

Systemtic Name: N-[(1R,2R)-1-(4-phenylpiperazin-1-ium-1-yl)-1-thiophen-2-yl-propan-2-yl]cyclohexanecarboxamide Openeye Name: N-[(1R,2R)-1-methyl-2-(4-phenylpiperazin-1-ium-1-yl)-2-(2-thienyl)ethyl]cyclohexanecarboxamide CAS Name: N-[(1R,2R)-1-(4-phenyl-1-piperazin-1-iumyl)-1-thiophen-2-ylpropan-2-yl]cyclohexanecarboxamide IUPAC Name: N-[(1R,2R)-1-(4-phenylpiperazin-1-ium-1-yl)-1-thiophen-2-ylpropan-2-yl]cyclohexanecarboxamide Traditional Name: N-[(1R,2R)-1-methyl-2-(4-phenylpiperazin-1-ium-1-yl)-2-(2-thienyl)ethyl]cyclohexanecarboxamide Formula: C24H34N3OS+ MolecularWeight: 412.61126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CS1)[NH+]2CCN(CC2)C3=CC=CC=C3)NC(=O)C4CCCCC4

Isomeric SMILES

C[C@H]([C@H](C1=CC=CS1)[NH+]2CCN(CC2)C3=CC=CC=C3)NC(=O)C4CCCCC4

InChI

InChI=1S/C24H33N3OS/c1-19(25-24(28)20-9-4-2-5-10-20)23(22-13-8-18-29-22)27-16-14-26(15-17-27)21-11-6-3-7-12-21/h3,6-8,11-13,18-20,23H,2,4-5,9-10,14-17H2,1H3,(H,25,28)/p+1/t19-,23-/m1/s1