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

Systemtic Name: 2-methoxy-1-[5-[(phenylmethyl)amino]-3-thiophen-2-yl-1,2,4-triazol-1-yl]ethanone Openeye Name: 1-[5-(benzylamino)-3-(2-thienyl)-1,2,4-triazol-1-yl]-2-methoxy-ethanone CAS Name: 2-methoxy-1-[5-[(phenylmethyl)amino]-3-thiophen-2-yl-1,2,4-triazol-1-yl]ethanone IUPAC Name: 1-[5-(benzylamino)-3-thiophen-2-yl-1,2,4-triazol-1-yl]-2-methoxyethanone Traditional Name: 1-[5-(benzylamino)-3-(2-thienyl)-1,2,4-triazol-1-yl]-2-methoxy-ethanone Formula: C16H16N4O2S MolecularWeight: 328.38884

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1C(=NC(=N1)C2=CC=CS2)NCC3=CC=CC=C3

Isomeric SMILES

COCC(=O)N1C(=NC(=N1)C2=CC=CS2)NCC3=CC=CC=C3

InChI

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