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

Systemtic Name: (2R)-N-(2-phenylphenyl)-2-[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]propanamide Openeye Name: (2R)-N-(2-phenylphenyl)-2-[4-(2-thienylmethyl)piperazine-1,4-diium-1-yl]propanamide CAS Name: (2R)-N-(2-phenylphenyl)-2-[4-(thiophen-2-ylmethyl)-1-piperazine-1,4-diiumyl]propanamide IUPAC Name: (2R)-N-(2-phenylphenyl)-2-[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]propanamide Traditional Name: (2R)-N-(2-phenylphenyl)-2-[4-(2-thenyl)piperazine-1,4-diium-1-yl]propionamide Formula: C24H29N3OS+2 MolecularWeight: 407.57156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C2=CC=CC=C2)[NH+]3CC[NH+](CC3)CC4=CC=CS4

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1C2=CC=CC=C2)[NH+]3CC[NH+](CC3)CC4=CC=CS4

InChI

InChI=1S/C24H27N3OS/c1-19(27-15-13-26(14-16-27)18-21-10-7-17-29-21)24(28)25-23-12-6-5-11-22(23)20-8-3-2-4-9-20/h2-12,17,19H,13-16,18H2,1H3,(H,25,28)/p+2/t19-/m1/s1