6-[butyl(methyl)amino]-1,4-dimethyl-2-oxidanylidene-5-[(Z)-[4-oxidanylidene-3-(phenylmethyl)-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-(phenylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]pyridine-3-carbonitrile Openeye Name: 5-[(Z)-(3-benzyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-6-[butyl(methyl)amino]-1,4-dimethyl-2-oxo-pyridine-3-carbonitrile CAS Name: 6-[butyl(methyl)amino]-1,4-dimethyl-2-oxo-5-[(Z)-[4-oxo-3-(phenylmethyl)-2-sulfanylidene-5-thiazolidinylidene]methyl]-3-pyridinecarbonitrile IUPAC Name: 5-[(Z)-(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-6-[butyl(methyl)amino]-1,4-dimethyl-2-oxopyridine-3-carbonitrile Traditional Name: 5-[(Z)-(3-benzyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-6-[butyl(methyl)amino]-2-keto-1,4-dimethyl-nicotinonitrile Formula: C24H26N4O2S2 MolecularWeight: 466.61884

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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=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)CC3=CC=CC=C3

InChI

InChI=1S/C24H26N4O2S2/c1-5-6-12-26(3)21-18(16(2)19(14-25)22(29)27(21)4)13-20-23(30)28(24(31)32-20)15-17-10-8-7-9-11-17/h7-11,13H,5-6,12,15H2,1-4H3/b20-13-