3-[4-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-butyl]-5-(phenylmethylidene)-4-sulfanylidene-1,3-thiazolidin-2-one

Systemtic Name: 3-[4-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-butyl]-5-(phenylmethylidene)-4-sulfanylidene-1,3-thiazolidin-2-one Openeye Name: 5-benzylidene-3-[4-(4-methylpiperazin-4-ium-1-yl)-4-oxo-butyl]-4-thioxo-thiazolidin-2-one CAS Name: 3-[4-(4-methyl-1-piperazin-4-iumyl)-4-oxobutyl]-5-(phenylmethylene)-4-sulfanylidene-2-thiazolidinone IUPAC Name: 5-benzylidene-3-[4-(4-methylpiperazin-4-ium-1-yl)-4-oxobutyl]-4-sulfanylidene-1,3-thiazolidin-2-one Traditional Name: 5-benzal-3-[4-keto-4-(4-methylpiperazin-4-ium-1-yl)butyl]-4-thioxo-thiazolidin-2-one Formula: C19H24N3O2S2+ MolecularWeight: 390.54276

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CCCN2C(=S)C(=CC3=CC=CC=C3)SC2=O

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CCCN2C(=S)C(=CC3=CC=CC=C3)SC2=O

InChI

InChI=1S/C19H23N3O2S2/c1-20-10-12-21(13-11-20)17(23)8-5-9-22-18(25)16(26-19(22)24)14-15-6-3-2-4-7-15/h2-4,6-7,14H,5,8-13H2,1H3/p+1