1,4-dimethyl-2-oxidanylidene-5-[(E)-[4-oxidanylidene-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-6-pyrrolidin-1-yl-pyridine-3-carbonitrile

Systemtic Name: 1,4-dimethyl-2-oxidanylidene-5-[(E)-[4-oxidanylidene-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-6-pyrrolidin-1-yl-pyridine-3-carbonitrile Openeye Name: 1,4-dimethyl-2-oxo-5-[(E)-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-thiazolidin-5-ylidene]methyl]-6-pyrrolidin-1-yl-pyridine-3-carbonitrile CAS Name: 1,4-dimethyl-2-oxo-5-[(E)-[4-oxo-3-(2-oxolanylmethyl)-2-sulfanylidene-5-thiazolidinylidene]methyl]-6-(1-pyrrolidinyl)-3-pyridinecarbonitrile IUPAC Name: 1,4-dimethyl-2-oxo-5-[(E)-[4-oxo-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-6-pyrrolidin-1-ylpyridine-3-carbonitrile Traditional Name: 2-keto-5-[(E)-[4-keto-3-(tetrahydrofurfuryl)-2-thioxo-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-6-pyrrolidino-nicotinonitrile Formula: C21H24N4O3S2 MolecularWeight: 444.57026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CC3CCCO3)N4CCCC4)C)C#N

Isomeric SMILES

CC1=C(C(=O)N(C(=C1/C=C/2\C(=O)N(C(=S)S2)CC3CCCO3)N4CCCC4)C)C#N

InChI

InChI=1S/C21H24N4O3S2/c1-13-15(18(24-7-3-4-8-24)23(2)19(26)16(13)11-22)10-17-20(27)25(21(29)30-17)12-14-6-5-9-28-14/h10,14H,3-9,12H2,1-2H3/b17-10+