N-[3-[3-[(3-cyanophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]phenyl]ethanamide

Systemtic Name: N-[3-[3-[(3-cyanophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]phenyl]ethanamide Openeye Name: N-[3-[3-[(3-cyanophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]phenyl]acetamide CAS Name: N-[3-[3-[(3-cyanophenyl)methylthio]-1,2,4-triazol-4-yl]phenyl]acetamide IUPAC Name: N-[3-[3-[(3-cyanophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]phenyl]acetamide Traditional Name: N-[3-[3-[(3-cyanobenzyl)thio]-1,2,4-triazol-4-yl]phenyl]acetamide Formula: C18H15N5OS MolecularWeight: 349.4096

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)N2C=NN=C2SCC3=CC=CC(=C3)C#N

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)N2C=NN=C2SCC3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H15N5OS/c1-13(24)21-16-6-3-7-17(9-16)23-12-20-22-18(23)25-11-15-5-2-4-14(8-15)10-19/h2-9,12H,11H2,1H3,(H,21,24)