(5S)-3-(2,4-dimethylphenyl)-5-(piperidin-1-ium-1-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: (5S)-3-(2,4-dimethylphenyl)-5-(piperidin-1-ium-1-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: (5S)-3-(2,4-dimethylphenyl)-5-(piperidin-1-ium-1-ylmethyl)-2-thioxo-thiazolidin-4-one CAS Name: (5S)-3-(2,4-dimethylphenyl)-5-(1-piperidin-1-iumylmethyl)-2-sulfanylidene-4-thiazolidinone IUPAC Name: (5S)-3-(2,4-dimethylphenyl)-5-(piperidin-1-ium-1-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: (5S)-3-(2,4-dimethylphenyl)-5-(piperidin-1-ium-1-ylmethyl)-2-thioxo-thiazolidin-4-one Formula: C17H23N2OS2+ MolecularWeight: 335.50732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=O)C(SC2=S)C[NH+]3CCCCC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=O)[C@@H](SC2=S)C[NH+]3CCCCC3)C

InChI

InChI=1S/C17H22N2OS2/c1-12-6-7-14(13(2)10-12)19-16(20)15(22-17(19)21)11-18-8-4-3-5-9-18/h6-7,10,15H,3-5,8-9,11H2,1-2H3/p+1/t15-/m0/s1