3-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-methoxy-benzaldehyde

Systemtic Name: 3-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-methoxy-benzaldehyde Openeye Name: 3-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-methoxy-benzaldehyde CAS Name: 3-[[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]methyl]-4-methoxybenzaldehyde IUPAC Name: 3-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-methoxybenzaldehyde Traditional Name: 3-[[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]methyl]-4-methoxy-benzaldehyde Formula: C14H15N3O2S MolecularWeight: 289.3528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=O)CSC2=NN=CN2C3CC3

Isomeric SMILES

COC1=C(C=C(C=C1)C=O)CSC2=NN=CN2C3CC3

InChI

InChI=1S/C14H15N3O2S/c1-19-13-5-2-10(7-18)6-11(13)8-20-14-16-15-9-17(14)12-3-4-12/h2,5-7,9,12H,3-4,8H2,1H3