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

Systemtic Name: 6-[butyl(methyl)amino]-5-[(Z)-[3-(furan-2-ylmethyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 6-[butyl(methyl)amino]-5-[(Z)-[3-(2-furylmethyl)-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxo-pyridine-3-carbonitrile CAS Name: 6-[butyl(methyl)amino]-5-[(Z)-[3-(2-furanylmethyl)-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]-1,4-dimethyl-2-oxo-3-pyridinecarbonitrile IUPAC Name: 6-[butyl(methyl)amino]-5-[(Z)-[3-(furan-2-ylmethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile Traditional Name: 6-[butyl(methyl)amino]-5-[(Z)-[3-(2-furfuryl)-4-keto-2-thioxo-thiazolidin-5-ylidene]methyl]-2-keto-1,4-dimethyl-nicotinonitrile Formula: C22H24N4O3S2 MolecularWeight: 456.58096

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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)CC3=CC=CO3

Isomeric SMILES

CCCCN(C)C1=C(C(=C(C(=O)N1C)C#N)C)/C=C\2/C(=O)N(C(=S)S2)CC3=CC=CO3

InChI

InChI=1S/C22H24N4O3S2/c1-5-6-9-24(3)19-16(14(2)17(12-23)20(27)25(19)4)11-18-21(28)26(22(30)31-18)13-15-8-7-10-29-15/h7-8,10-11H,5-6,9,13H2,1-4H3/b18-11-