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

Systemtic Name: 5-[(Z)-(3-butan-2-yl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-ethyl-4-methyl-6-morpholin-4-yl-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 1-ethyl-4-methyl-6-morpholino-2-oxo-5-[(Z)-(4-oxo-3-sec-butyl-2-thioxo-thiazolidin-5-ylidene)methyl]pyridine-3-carbonitrile CAS Name: 5-[(Z)-(3-butan-2-yl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]-1-ethyl-4-methyl-6-(4-morpholinyl)-2-oxo-3-pyridinecarbonitrile IUPAC Name: 5-[(Z)-(3-butan-2-yl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-ethyl-4-methyl-6-morpholin-4-yl-2-oxopyridine-3-carbonitrile Traditional Name: 1-ethyl-2-keto-5-[(Z)-(4-keto-3-sec-butyl-2-thioxo-thiazolidin-5-ylidene)methyl]-4-methyl-6-morpholino-nicotinonitrile Formula: C21H26N4O3S2 MolecularWeight: 446.58614

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C(=CC2=C(N(C(=O)C(=C2C)C#N)CC)N3CCOCC3)SC1=S

Isomeric SMILES

CCC(C)N1C(=O)/C(=C/C2=C(N(C(=O)C(=C2C)C#N)CC)N3CCOCC3)/SC1=S

InChI

InChI=1S/C21H26N4O3S2/c1-5-13(3)25-20(27)17(30-21(25)29)11-15-14(4)16(12-22)19(26)24(6-2)18(15)23-7-9-28-10-8-23/h11,13H,5-10H2,1-4H3/b17-11-