3-[(4-azanyl-5-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-methoxy-benzaldehyde

Systemtic Name: 3-[(4-azanyl-5-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-methoxy-benzaldehyde Openeye Name: 3-[(4-amino-5-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-methoxy-benzaldehyde CAS Name: 3-[[(4-amino-5-ethyl-1,2,4-triazol-3-yl)thio]methyl]-4-methoxybenzaldehyde IUPAC Name: 3-[(4-amino-5-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-methoxybenzaldehyde Traditional Name: 3-[[(4-amino-5-ethyl-1,2,4-triazol-3-yl)thio]methyl]-4-methoxy-benzaldehyde Formula: C13H16N4O2S MolecularWeight: 292.35674

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1N)SCC2=C(C=CC(=C2)C=O)OC

Isomeric SMILES

CCC1=NN=C(N1N)SCC2=C(C=CC(=C2)C=O)OC

InChI

InChI=1S/C13H16N4O2S/c1-3-12-15-16-13(17(12)14)20-8-10-6-9(7-18)4-5-11(10)19-2/h4-7H,3,8,14H2,1-2H3