6-(4-ethylpiperazin-4-ium-1-yl)-1,4-dimethyl-2-oxidanylidene-5-[(Z)-(4-oxidanylidene-3-pentyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyridine-3-carbonitrile

Systemtic Name: 6-(4-ethylpiperazin-4-ium-1-yl)-1,4-dimethyl-2-oxidanylidene-5-[(Z)-(4-oxidanylidene-3-pentyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyridine-3-carbonitrile Openeye Name: 6-(4-ethylpiperazin-4-ium-1-yl)-1,4-dimethyl-2-oxo-5-[(Z)-(4-oxo-3-pentyl-2-thioxo-thiazolidin-5-ylidene)methyl]pyridine-3-carbonitrile CAS Name: 6-(4-ethyl-1-piperazin-4-iumyl)-1,4-dimethyl-2-oxo-5-[(Z)-(4-oxo-3-pentyl-2-sulfanylidene-5-thiazolidinylidene)methyl]-3-pyridinecarbonitrile IUPAC Name: 6-(4-ethylpiperazin-4-ium-1-yl)-1,4-dimethyl-2-oxo-5-[(Z)-(4-oxo-3-pentyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyridine-3-carbonitrile Traditional Name: 5-[(Z)-(3-amyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-6-(4-ethylpiperazin-4-ium-1-yl)-2-keto-1,4-dimethyl-nicotinonitrile Formula: C23H32N5O2S2+ MolecularWeight: 474.66248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C(=CC2=C(N(C(=O)C(=C2C)C#N)C)N3CC[NH+](CC3)CC)SC1=S

Isomeric SMILES

CCCCCN1C(=O)/C(=C/C2=C(N(C(=O)C(=C2C)C#N)C)N3CC[NH+](CC3)CC)/SC1=S

InChI

InChI=1S/C23H31N5O2S2/c1-5-7-8-9-28-22(30)19(32-23(28)31)14-17-16(3)18(15-24)21(29)25(4)20(17)27-12-10-26(6-2)11-13-27/h14H,5-13H2,1-4H3/p+1/b19-14-