2-[[4-azanyl-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanenitrile

Systemtic Name: 2-[[4-azanyl-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanenitrile Openeye Name: 2-[[4-amino-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetonitrile CAS Name: 2-[[4-amino-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]thio]acetonitrile IUPAC Name: 2-[[4-amino-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetonitrile Traditional Name: 2-[[4-amino-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]thio]acetonitrile Formula: C10H7Cl2N5S MolecularWeight: 300.16708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)C2=NN=C(N2N)SCC#N

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)C2=NN=C(N2N)SCC#N

InChI

InChI=1S/C10H7Cl2N5S/c11-6-1-2-7(8(12)5-6)9-15-16-10(17(9)14)18-4-3-13/h1-2,5H,4,14H2