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

Systemtic Name: 6-[butyl(methyl)amino]-1,4-dimethyl-2-oxidanylidene-5-[(Z)-[4-oxidanylidene-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]pyridine-3-carbonitrile Openeye Name: 6-[butyl(methyl)amino]-1,4-dimethyl-2-oxo-5-[(Z)-[4-oxo-3-(1-phenylethyl)-2-thioxo-thiazolidin-5-ylidene]methyl]pyridine-3-carbonitrile CAS Name: 6-[butyl(methyl)amino]-1,4-dimethyl-2-oxo-5-[(Z)-[4-oxo-3-(1-phenylethyl)-2-sulfanylidene-5-thiazolidinylidene]methyl]-3-pyridinecarbonitrile IUPAC Name: 6-[butyl(methyl)amino]-1,4-dimethyl-2-oxo-5-[(Z)-[4-oxo-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]pyridine-3-carbonitrile Traditional Name: 6-[butyl(methyl)amino]-2-keto-5-[(Z)-[4-keto-3-(1-phenylethyl)-2-thioxo-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-nicotinonitrile Formula: C25H28N4O2S2 MolecularWeight: 480.64542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C1=C(C(=C(C(=O)N1C)C#N)C)C=C2C(=O)N(C(=S)S2)C(C)C3=CC=CC=C3

Isomeric SMILES

CCCCN(C)C1=C(C(=C(C(=O)N1C)C#N)C)/C=C\2/C(=O)N(C(=S)S2)C(C)C3=CC=CC=C3

InChI

InChI=1S/C25H28N4O2S2/c1-6-7-13-27(4)22-19(16(2)20(15-26)23(30)28(22)5)14-21-24(31)29(25(32)33-21)17(3)18-11-9-8-10-12-18/h8-12,14,17H,6-7,13H2,1-5H3/b21-14-