4-[[4-methyl-5-(2-methylfuran-3-yl)-1,2,4-triazol-3-yl]sulfanyl]butanenitrile

Systemtic Name: 4-[[4-methyl-5-(2-methylfuran-3-yl)-1,2,4-triazol-3-yl]sulfanyl]butanenitrile Openeye Name: 4-[[4-methyl-5-(2-methyl-3-furyl)-1,2,4-triazol-3-yl]sulfanyl]butanenitrile CAS Name: 4-[[4-methyl-5-(2-methyl-3-furanyl)-1,2,4-triazol-3-yl]thio]butanenitrile IUPAC Name: 4-[[4-methyl-5-(2-methylfuran-3-yl)-1,2,4-triazol-3-yl]sulfanyl]butanenitrile Traditional Name: 4-[[4-methyl-5-(2-methyl-3-furyl)-1,2,4-triazol-3-yl]thio]butyronitrile Formula: C12H14N4OS MolecularWeight: 262.33076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C2=NN=C(N2C)SCCCC#N

Isomeric SMILES

CC1=C(C=CO1)C2=NN=C(N2C)SCCCC#N

InChI

InChI=1S/C12H14N4OS/c1-9-10(5-7-17-9)11-14-15-12(16(11)2)18-8-4-3-6-13/h5,7H,3-4,8H2,1-2H3