2-ethanimidoyl-3-oxidanylidene-4-[[4-[[(2R)-oxolan-2-yl]methyl]-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]butanenitrile

Systemtic Name: 2-ethanimidoyl-3-oxidanylidene-4-[[4-[[(2R)-oxolan-2-yl]methyl]-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]butanenitrile Openeye Name: 2-ethanimidoyl-3-oxo-4-[[4-[[(2R)-tetrahydrofuran-2-yl]methyl]-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]butanenitrile CAS Name: 2-(1-iminoethyl)-3-oxo-4-[[4-[[(2R)-2-oxolanyl]methyl]-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]butanenitrile IUPAC Name: 2-ethanimidoyl-3-oxo-4-[[4-[[(2R)-oxolan-2-yl]methyl]-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]butanenitrile Traditional Name: 2-acetimidoyl-3-keto-4-[[4-[[(2R)-tetrahydrofuran-2-yl]methyl]-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]butyronitrile Formula: C17H19N5O2S2 MolecularWeight: 389.49506

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CSC1=NN=C(N1CC2CCCO2)C3=CC=CS3

Isomeric SMILES

CC(=N)C(C#N)C(=O)CSC1=NN=C(N1C[C@H]2CCCO2)C3=CC=CS3

InChI

InChI=1S/C17H19N5O2S2/c1-11(19)13(8-18)14(23)10-26-17-21-20-16(15-5-3-7-25-15)22(17)9-12-4-2-6-24-12/h3,5,7,12-13,19H,2,4,6,9-10H2,1H3/t12-,13?/m1/s1