N-[(3R)-3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[(3R)-3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[(3R)-3-methyl-1,1-dioxo-thiolan-3-yl]-2-(4-phenylpiperazin-1-ium-1-yl)acetamide CAS Name: N-[(3R)-3-methyl-1,1-dioxo-3-thiolanyl]-2-(4-phenyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[(3R)-3-methyl-1,1-dioxothiolan-3-yl]-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-[(3R)-1,1-diketo-3-methyl-thiolan-3-yl]-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Formula: C17H26N3O3S+ MolecularWeight: 352.47164

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCS(=O)(=O)C1)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

C[C@]1(CCS(=O)(=O)C1)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C17H25N3O3S/c1-17(7-12-24(22,23)14-17)18-16(21)13-19-8-10-20(11-9-19)15-5-3-2-4-6-15/h2-6H,7-14H2,1H3,(H,18,21)/p+1/t17-/m1/s1