4-[(4-cyclopropyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-butanenitrile

Systemtic Name: 4-[(4-cyclopropyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-butanenitrile Openeye Name: 4-[(4-cyclopropyl-5-morpholino-1,2,4-triazol-3-yl)sulfanyl]-2-(4-methylthiazol-2-yl)-3-oxo-butanenitrile CAS Name: 4-[[4-cyclopropyl-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]-2-(4-methyl-2-thiazolyl)-3-oxobutanenitrile IUPAC Name: 4-[(4-cyclopropyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-2-(4-methyl-1,3-thiazol-2-yl)-3-oxobutanenitrile Traditional Name: 4-[(4-cyclopropyl-5-morpholino-1,2,4-triazol-3-yl)thio]-3-keto-2-(4-methylthiazol-2-yl)butyronitrile Formula: C17H20N6O2S2 MolecularWeight: 404.5097

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(C#N)C(=O)CSC2=NN=C(N2C3CC3)N4CCOCC4

Isomeric SMILES

CC1=CSC(=N1)C(C#N)C(=O)CSC2=NN=C(N2C3CC3)N4CCOCC4

InChI

InChI=1S/C17H20N6O2S2/c1-11-9-26-15(19-11)13(8-18)14(24)10-27-17-21-20-16(23(17)12-2-3-12)22-4-6-25-7-5-22/h9,12-13H,2-7,10H2,1H3