ethyl 2-[[4-phenyl-5-(phenylazanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: ethyl 2-[[4-phenyl-5-(phenylazanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[[5-(anilinomethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[5-(anilinomethyl)-4-phenyl-1,2,4-triazol-3-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[5-(anilinomethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[5-(anilinomethyl)-4-phenyl-1,2,4-triazol-3-yl]thio]acetic acid ethyl ester Formula: C19H20N4O2S MolecularWeight: 368.4527

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NN=C(N1C2=CC=CC=C2)CNC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CSC1=NN=C(N1C2=CC=CC=C2)CNC3=CC=CC=C3

InChI

InChI=1S/C19H20N4O2S/c1-2-25-18(24)14-26-19-22-21-17(13-20-15-9-5-3-6-10-15)23(19)16-11-7-4-8-12-16/h3-12,20H,2,13-14H2,1H3