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

Systemtic Name: 1,4-dimethyl-6-(4-methylpiperazin-1-yl)-2-oxidanylidene-5-[(Z)-(4-oxidanylidene-3-phenethyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyridine-3-carbonitrile Openeye Name: 1,4-dimethyl-6-(4-methylpiperazin-1-yl)-2-oxo-5-[(Z)-(4-oxo-3-phenethyl-2-thioxo-thiazolidin-5-ylidene)methyl]pyridine-3-carbonitrile CAS Name: 1,4-dimethyl-6-(4-methyl-1-piperazinyl)-2-oxo-5-[(Z)-(4-oxo-3-phenethyl-2-sulfanylidene-5-thiazolidinylidene)methyl]-3-pyridinecarbonitrile IUPAC Name: 1,4-dimethyl-6-(4-methylpiperazin-1-yl)-2-oxo-5-[(Z)-(4-oxo-3-phenethyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyridine-3-carbonitrile Traditional Name: 2-keto-5-[(Z)-(4-keto-3-phenethyl-2-thioxo-thiazolidin-5-ylidene)methyl]-1,4-dimethyl-6-(4-methylpiperazino)nicotinonitrile Formula: C25H27N5O2S2 MolecularWeight: 493.64418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC=CC=C3)N4CCN(CC4)C)C)C#N

Isomeric SMILES

CC1=C(C(=O)N(C(=C1/C=C\2/C(=O)N(C(=S)S2)CCC3=CC=CC=C3)N4CCN(CC4)C)C)C#N

InChI

InChI=1S/C25H27N5O2S2/c1-17-19(22(28(3)23(31)20(17)16-26)29-13-11-27(2)12-14-29)15-21-24(32)30(25(33)34-21)10-9-18-7-5-4-6-8-18/h4-8,15H,9-14H2,1-3H3/b21-15-