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

Systemtic Name: (2R)-2-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanenitrile Openeye Name: (2R)-2-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanenitrile CAS Name: (2R)-2-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)thio]propanenitrile IUPAC Name: (2R)-2-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanenitrile Traditional Name: (2R)-2-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)thio]propionitrile Formula: C17H20N4S MolecularWeight: 312.4325

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)SC1=NN(C(=N1)C2CCCCC2)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C#N)SC1=NN(C(=N1)C2CCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C17H20N4S/c1-13(12-18)22-17-19-16(14-8-4-2-5-9-14)21(20-17)15-10-6-3-7-11-15/h3,6-7,10-11,13-14H,2,4-5,8-9H2,1H3/t13-/m1/s1