butyl 2-(4-phenyl-5-thiophen-3-yl-1,2,3-triazol-1-yl)ethanoate

Systemtic Name: butyl 2-(4-phenyl-5-thiophen-3-yl-1,2,3-triazol-1-yl)ethanoate Openeye Name: butyl 2-[4-phenyl-5-(3-thienyl)triazol-1-yl]acetate CAS Name: 2-[4-phenyl-5-(3-thiophenyl)-1-triazolyl]acetic acid butyl ester IUPAC Name: butyl 2-(4-phenyl-5-thiophen-3-yltriazol-1-yl)acetate Traditional Name: 2-[4-phenyl-5-(3-thienyl)triazol-1-yl]acetic acid butyl ester Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CN1C(=C(N=N1)C2=CC=CC=C2)C3=CSC=C3

Isomeric SMILES

CCCCOC(=O)CN1C(=C(N=N1)C2=CC=CC=C2)C3=CSC=C3

InChI

InChI=1S/C18H19N3O2S/c1-2-3-10-23-16(22)12-21-18(15-9-11-24-13-15)17(19-20-21)14-7-5-4-6-8-14/h4-9,11,13H,2-3,10,12H2,1H3