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

Systemtic Name: 5-[(Z)-(3-butyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,4-dimethyl-2-oxidanylidene-6-(4-phenylpiperazin-1-yl)pyridine-3-carbonitrile Openeye Name: 5-[(Z)-(3-butyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-1,4-dimethyl-2-oxo-6-(4-phenylpiperazin-1-yl)pyridine-3-carbonitrile CAS Name: 5-[(Z)-(3-butyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]-1,4-dimethyl-2-oxo-6-(4-phenyl-1-piperazinyl)-3-pyridinecarbonitrile IUPAC Name: 5-[(Z)-(3-butyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,4-dimethyl-2-oxo-6-(4-phenylpiperazin-1-yl)pyridine-3-carbonitrile Traditional Name: 5-[(Z)-(3-butyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-2-keto-1,4-dimethyl-6-(4-phenylpiperazino)nicotinonitrile Formula: C26H29N5O2S2 MolecularWeight: 507.67076

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=CC2=C(N(C(=O)C(=C2C)C#N)C)N3CCN(CC3)C4=CC=CC=C4)SC1=S

Isomeric SMILES

CCCCN1C(=O)/C(=C/C2=C(N(C(=O)C(=C2C)C#N)C)N3CCN(CC3)C4=CC=CC=C4)/SC1=S

InChI

InChI=1S/C26H29N5O2S2/c1-4-5-11-31-25(33)22(35-26(31)34)16-20-18(2)21(17-27)24(32)28(3)23(20)30-14-12-29(13-15-30)19-9-7-6-8-10-19/h6-10,16H,4-5,11-15H2,1-3H3/b22-16-