2-methoxy-1-[3-phenyl-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]ethanone

Systemtic Name: 2-methoxy-1-[3-phenyl-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]ethanone Openeye Name: 2-methoxy-1-[3-phenyl-5-(2-thienylmethylamino)-1,2,4-triazol-1-yl]ethanone CAS Name: 2-methoxy-1-[3-phenyl-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]ethanone IUPAC Name: 2-methoxy-1-[3-phenyl-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]ethanone Traditional Name: 2-methoxy-1-[3-phenyl-5-(2-thenylamino)-1,2,4-triazol-1-yl]ethanone Formula: C16H16N4O2S MolecularWeight: 328.38884

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1C(=NC(=N1)C2=CC=CC=C2)NCC3=CC=CS3

Isomeric SMILES

COCC(=O)N1C(=NC(=N1)C2=CC=CC=C2)NCC3=CC=CS3

InChI

InChI=1S/C16H16N4O2S/c1-22-11-14(21)20-16(17-10-13-8-5-9-23-13)18-15(19-20)12-6-3-2-4-7-12/h2-9H,10-11H2,1H3,(H,17,18,19)