methyl-[(3S)-1-[2-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl)ethanoyl]piperidin-3-yl]-phenethyl-azanium

Systemtic Name: methyl-[(3S)-1-[2-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl)ethanoyl]piperidin-3-yl]-phenethyl-azanium Openeye Name: methyl-[(3S)-1-[2-(4-oxo-2-thioxo-thiazolidin-3-yl)acetyl]-3-piperidyl]-phenethyl-ammonium CAS Name: methyl-[(3S)-1-[1-oxo-2-(4-oxo-2-sulfanylidene-3-thiazolidinyl)ethyl]-3-piperidinyl]-phenethylammonium IUPAC Name: methyl-[(3S)-1-[2-(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)acetyl]piperidin-3-yl]-phenethylazanium Traditional Name: [(3S)-1-[2-(4-keto-2-thioxo-thiazolidin-3-yl)acetyl]-3-piperidyl]-methyl-phenethyl-ammonium Formula: C19H26N3O2S2+ MolecularWeight: 392.55864

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=C1)C2CCCN(C2)C(=O)CN3C(=O)CSC3=S

Isomeric SMILES

C[NH+](CCC1=CC=CC=C1)[C@H]2CCCN(C2)C(=O)CN3C(=O)CSC3=S

InChI

InChI=1S/C19H25N3O2S2/c1-20(11-9-15-6-3-2-4-7-15)16-8-5-10-21(12-16)17(23)13-22-18(24)14-26-19(22)25/h2-4,6-7,16H,5,8-14H2,1H3/p+1/t16-/m0/s1