1-ethyl-4-methyl-6-morpholin-4-yl-2-oxidanylidene-5-[(Z)-[4-oxidanylidene-3-(3-phenylpropyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]pyridine-3-carbonitrile

Systemtic Name: 1-ethyl-4-methyl-6-morpholin-4-yl-2-oxidanylidene-5-[(Z)-[4-oxidanylidene-3-(3-phenylpropyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]pyridine-3-carbonitrile Openeye Name: 1-ethyl-4-methyl-6-morpholino-2-oxo-5-[(Z)-[4-oxo-3-(3-phenylpropyl)-2-thioxo-thiazolidin-5-ylidene]methyl]pyridine-3-carbonitrile CAS Name: 1-ethyl-4-methyl-6-(4-morpholinyl)-2-oxo-5-[(Z)-[4-oxo-3-(3-phenylpropyl)-2-sulfanylidene-5-thiazolidinylidene]methyl]-3-pyridinecarbonitrile IUPAC Name: 1-ethyl-4-methyl-6-morpholin-4-yl-2-oxo-5-[(Z)-[4-oxo-3-(3-phenylpropyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]pyridine-3-carbonitrile Traditional Name: 1-ethyl-2-keto-5-[(Z)-[4-keto-3-(3-phenylpropyl)-2-thioxo-thiazolidin-5-ylidene]methyl]-4-methyl-6-morpholino-nicotinonitrile Formula: C26H28N4O3S2 MolecularWeight: 508.65552

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C(C1=O)C#N)C)C=C2C(=O)N(C(=S)S2)CCCC3=CC=CC=C3)N4CCOCC4

Isomeric SMILES

CCN1C(=C(C(=C(C1=O)C#N)C)/C=C\2/C(=O)N(C(=S)S2)CCCC3=CC=CC=C3)N4CCOCC4

InChI

InChI=1S/C26H28N4O3S2/c1-3-29-23(28-12-14-33-15-13-28)20(18(2)21(17-27)24(29)31)16-22-25(32)30(26(34)35-22)11-7-10-19-8-5-4-6-9-19/h4-6,8-9,16H,3,7,10-15H2,1-2H3/b22-16-