3-[[5-(2,4-dichlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanenitrile

Systemtic Name: 3-[[5-(2,4-dichlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanenitrile Openeye Name: 3-[[5-(2,4-dichlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanenitrile CAS Name: 3-[[5-(2,4-dichlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]propanenitrile IUPAC Name: 3-[[5-(2,4-dichlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanenitrile Traditional Name: 3-[[5-(2,4-dichlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]propionitrile Formula: C17H12Cl2N4S MolecularWeight: 375.27498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCCC#N)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCCC#N)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H12Cl2N4S/c18-12-7-8-14(15(19)11-12)16-21-22-17(24-10-4-9-20)23(16)13-5-2-1-3-6-13/h1-3,5-8,11H,4,10H2