5-[[4-ethyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]furan-2-carbaldehyde

Systemtic Name: 5-[[4-ethyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]furan-2-carbaldehyde Openeye Name: 5-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]furan-2-carbaldehyde CAS Name: 5-[[4-ethyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-2-furancarboxaldehyde IUPAC Name: 5-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]furan-2-carbaldehyde Traditional Name: 5-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)thio]furfural Formula: C16H15N3O2S MolecularWeight: 313.3742

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC2=CC=C(O2)C=O)CC3=CC=CC=C3

Isomeric SMILES

CCN1C(=NN=C1SC2=CC=C(O2)C=O)CC3=CC=CC=C3

InChI

InChI=1S/C16H15N3O2S/c1-2-19-14(10-12-6-4-3-5-7-12)17-18-16(19)22-15-9-8-13(11-20)21-15/h3-9,11H,2,10H2,1H3