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

Systemtic Name: 6-(azepan-1-yl)-5-[[3-(3-ethoxypropyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 6-(azepan-1-yl)-5-[[3-(3-ethoxypropyl)-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxo-pyridine-3-carbonitrile CAS Name: 6-(1-azepanyl)-5-[[3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]-1,4-dimethyl-2-oxo-3-pyridinecarbonitrile IUPAC Name: 6-(azepan-1-yl)-5-[[3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile Traditional Name: 6-(azepan-1-yl)-5-[[3-(3-ethoxypropyl)-4-keto-2-thioxo-thiazolidin-5-ylidene]methyl]-2-keto-1,4-dimethyl-nicotinonitrile Formula: C23H30N4O3S2 MolecularWeight: 474.6393

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=O)C(=CC2=C(N(C(=O)C(=C2C)C#N)C)N3CCCCCC3)SC1=S

Isomeric SMILES

CCOCCCN1C(=O)C(=CC2=C(N(C(=O)C(=C2C)C#N)C)N3CCCCCC3)SC1=S

InChI

InChI=1S/C23H30N4O3S2/c1-4-30-13-9-12-27-22(29)19(32-23(27)31)14-17-16(2)18(15-24)21(28)25(3)20(17)26-10-7-5-6-8-11-26/h14H,4-13H2,1-3H3