(5Z)-5-(2-methyl-3-phenyl-prop-2-enylidene)-3-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxidanylidene-propyl]-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: (5Z)-5-(2-methyl-3-phenyl-prop-2-enylidene)-3-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxidanylidene-propyl]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: (5Z)-5-(2-methyl-3-phenyl-prop-2-enylidene)-3-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxo-propyl]-2-thioxo-thiazolidin-4-one CAS Name: (5Z)-5-(2-methyl-3-phenylprop-2-enylidene)-3-[3-(4-methyl-1-piperazin-4-iumyl)-3-oxopropyl]-2-sulfanylidene-4-thiazolidinone IUPAC Name: (5Z)-5-(2-methyl-3-phenylprop-2-enylidene)-3-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxopropyl]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: (5Z)-3-[3-keto-3-(4-methylpiperazin-4-ium-1-yl)propyl]-5-(2-methyl-3-phenyl-prop-2-enylidene)-2-thioxo-thiazolidin-4-one Formula: C21H26N3O2S2+ MolecularWeight: 416.58004

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC(=CC1=CC=CC=C1)/C=C\2/C(=O)N(C(=S)S2)CCC(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C21H25N3O2S2/c1-16(14-17-6-4-3-5-7-17)15-18-20(26)24(21(27)28-18)9-8-19(25)23-12-10-22(2)11-13-23/h3-7,14-15H,8-13H2,1-2H3/p+1/b16-14?,18-15-