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

Systemtic Name: 1-(3-ethoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)-2-phenyl-butan-1-one Openeye Name: 1-[3-ethoxy-5-(2-thienyl)-1,2,4-triazol-1-yl]-2-phenyl-butan-1-one CAS Name: 1-(3-ethoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)-2-phenyl-1-butanone IUPAC Name: 1-(3-ethoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)-2-phenylbutan-1-one Traditional Name: 1-[3-ethoxy-5-(2-thienyl)-1,2,4-triazol-1-yl]-2-phenyl-butan-1-one Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)N2C(=NC(=N2)OCC)C3=CC=CS3

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)N2C(=NC(=N2)OCC)C3=CC=CS3

InChI

InChI=1S/C18H19N3O2S/c1-3-14(13-9-6-5-7-10-13)17(22)21-16(15-11-8-12-24-15)19-18(20-21)23-4-2/h5-12,14H,3-4H2,1-2H3