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

Systemtic Name: 4-[2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]ethoxy]-3-methoxy-benzaldehyde Openeye Name: 4-[2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]ethoxy]-3-methoxy-benzaldehyde CAS Name: 4-[2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]ethoxy]-3-methoxybenzaldehyde IUPAC Name: 4-[2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]ethoxy]-3-methoxybenzaldehyde Traditional Name: 4-[2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]ethoxy]-3-methoxy-benzaldehyde Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C)SCCOC2=C(C=C(C=C2)C=O)OC

Isomeric SMILES

CC1=NN=C(N1C)SCCOC2=C(C=C(C=C2)C=O)OC

InChI

InChI=1S/C14H17N3O3S/c1-10-15-16-14(17(10)2)21-7-6-20-12-5-4-11(9-18)8-13(12)19-3/h4-5,8-9H,6-7H2,1-3H3