2-phenyl-1-(3-propoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)butan-1-one

Systemtic Name: 2-phenyl-1-(3-propoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)butan-1-one Openeye Name: 2-phenyl-1-[3-propoxy-5-(2-thienyl)-1,2,4-triazol-1-yl]butan-1-one CAS Name: 2-phenyl-1-(3-propoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)-1-butanone IUPAC Name: 2-phenyl-1-(3-propoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)butan-1-one Traditional Name: 2-phenyl-1-[3-propoxy-5-(2-thienyl)-1,2,4-triazol-1-yl]butan-1-one Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NN(C(=N1)C2=CC=CS2)C(=O)C(CC)C3=CC=CC=C3

Isomeric SMILES

CCCOC1=NN(C(=N1)C2=CC=CS2)C(=O)C(CC)C3=CC=CC=C3

InChI

InChI=1S/C19H21N3O2S/c1-3-12-24-19-20-17(16-11-8-13-25-16)22(21-19)18(23)15(4-2)14-9-6-5-7-10-14/h5-11,13,15H,3-4,12H2,1-2H3