(2R)-N-(cyclohexylcarbamoyl)-2-[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]propanamide

Systemtic Name: (2R)-N-(cyclohexylcarbamoyl)-2-[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]propanamide Openeye Name: (2R)-N-(cyclohexylcarbamoyl)-2-[4-(2-thienylmethyl)piperazine-1,4-diium-1-yl]propanamide CAS Name: (2R)-N-[(cyclohexylamino)-oxomethyl]-2-[4-(thiophen-2-ylmethyl)-1-piperazine-1,4-diiumyl]propanamide IUPAC Name: (2R)-N-(cyclohexylcarbamoyl)-2-[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]propanamide Traditional Name: (2R)-N-(cyclohexylcarbamoyl)-2-[4-(2-thenyl)piperazine-1,4-diium-1-yl]propionamide Formula: C19H32N4O2S+2 MolecularWeight: 380.54798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1CCCCC1)[NH+]2CC[NH+](CC2)CC3=CC=CS3

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC1CCCCC1)[NH+]2CC[NH+](CC2)CC3=CC=CS3

InChI

InChI=1S/C19H30N4O2S/c1-15(18(24)21-19(25)20-16-6-3-2-4-7-16)23-11-9-22(10-12-23)14-17-8-5-13-26-17/h5,8,13,15-16H,2-4,6-7,9-12,14H2,1H3,(H2,20,21,24,25)/p+2/t15-/m1/s1