4-[[4-(oxolan-2-ylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]butanenitrile

Systemtic Name: 4-[[4-(oxolan-2-ylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]butanenitrile Openeye Name: 4-[[4-(tetrahydrofuran-2-ylmethyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]butanenitrile CAS Name: 4-[[4-(2-oxolanylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]butanenitrile IUPAC Name: 4-[[4-(oxolan-2-ylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]butanenitrile Traditional Name: 4-[[4-(tetrahydrofurfuryl)-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]butyronitrile Formula: C15H18N4OS2 MolecularWeight: 334.45962

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=NN=C2SCCCC#N)C3=CC=CS3

Isomeric SMILES

C1CC(OC1)CN2C(=NN=C2SCCCC#N)C3=CC=CS3

InChI

InChI=1S/C15H18N4OS2/c16-7-1-2-9-22-15-18-17-14(13-6-4-10-21-13)19(15)11-12-5-3-8-20-12/h4,6,10,12H,1-3,5,8-9,11H2