N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-cyclopropyl-2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-cyclopropyl-2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-cyclopropyl-N-[(3S)-1,1-dioxothiolan-3-yl]-2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-N-[(3S)-1,1-dioxo-3-thiolanyl]-2-[4-(2-naphthalenylsulfonyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-N-[(3S)-1,1-dioxothiolan-3-yl]-2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-cyclopropyl-N-[(3S)-1,1-diketothiolan-3-yl]-2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]acetamide Formula: C23H30N3O5S2+ MolecularWeight: 492.6314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(C2CCS(=O)(=O)C2)C(=O)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1N(C2CC2)C(=O)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C23H29N3O5S2/c27-23(26(20-6-7-20)21-9-14-32(28,29)17-21)16-24-10-12-25(13-11-24)33(30,31)22-8-5-18-3-1-2-4-19(18)15-22/h1-5,8,15,20-21H,6-7,9-14,16-17H2/p+1/t21-/m0/s1