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

Systemtic Name: 1,4-dimethyl-2-oxidanylidene-5-[(Z)-(4-oxidanylidene-3-propan-2-yl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-6-(4-phenylpiperazin-1-yl)pyridine-3-carbonitrile Openeye Name: 5-[(Z)-(3-isopropyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-1,4-dimethyl-2-oxo-6-(4-phenylpiperazin-1-yl)pyridine-3-carbonitrile CAS Name: 1,4-dimethyl-2-oxo-5-[(Z)-(4-oxo-3-propan-2-yl-2-sulfanylidene-5-thiazolidinylidene)methyl]-6-(4-phenyl-1-piperazinyl)-3-pyridinecarbonitrile IUPAC Name: 1,4-dimethyl-2-oxo-5-[(Z)-(4-oxo-3-propan-2-yl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-6-(4-phenylpiperazin-1-yl)pyridine-3-carbonitrile Traditional Name: 5-[(Z)-(3-isopropyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-2-keto-1,4-dimethyl-6-(4-phenylpiperazino)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)C(C)C)N3CCN(CC3)C4=CC=CC=C4)C)C#N

Isomeric SMILES

CC1=C(C(=O)N(C(=C1/C=C\2/C(=O)N(C(=S)S2)C(C)C)N3CCN(CC3)C4=CC=CC=C4)C)C#N

InChI

InChI=1S/C25H27N5O2S2/c1-16(2)30-24(32)21(34-25(30)33)14-19-17(3)20(15-26)23(31)27(4)22(19)29-12-10-28(11-13-29)18-8-6-5-7-9-18/h5-9,14,16H,10-13H2,1-4H3/b21-14-