3-methoxy-4-[2-[(4-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethoxy]benzaldehyde

Systemtic Name: 3-methoxy-4-[2-[(4-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethoxy]benzaldehyde Openeye Name: 4-[2-[(5-isopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethoxy]-3-methoxy-benzaldehyde CAS Name: 3-methoxy-4-[2-[(4-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)thio]ethoxy]benzaldehyde IUPAC Name: 3-methoxy-4-[2-[(4-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethoxy]benzaldehyde Traditional Name: 4-[2-[(5-isopropyl-4-methyl-1,2,4-triazol-3-yl)thio]ethoxy]-3-methoxy-benzaldehyde Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1C)SCCOC2=C(C=C(C=C2)C=O)OC

Isomeric SMILES

CC(C)C1=NN=C(N1C)SCCOC2=C(C=C(C=C2)C=O)OC

InChI

InChI=1S/C16H21N3O3S/c1-11(2)15-17-18-16(19(15)3)23-8-7-22-13-6-5-12(10-20)9-14(13)21-4/h5-6,9-11H,7-8H2,1-4H3