2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanenitrile

Systemtic Name: 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanenitrile Openeye Name: 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanenitrile CAS Name: 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]thio]propanenitrile IUPAC Name: 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanenitrile Traditional Name: 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]thio]propionitrile Formula: C11H9ClN4S MolecularWeight: 264.73396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)SC1=NN=CN1C2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C#N)SC1=NN=CN1C2=CC(=CC=C2)Cl

InChI

InChI=1S/C11H9ClN4S/c1-8(6-13)17-11-15-14-7-16(11)10-4-2-3-9(12)5-10/h2-5,7-8H,1H3