N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[(4-benzyloxy-3-methoxy-phenyl)methyl]-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(4-benzoxy-3-methoxy-benzyl)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCC(=O)NCC2=CC(=C(C=C2)OCC3=CC=CC=C3)OC

Isomeric SMILES

CN1C=NN=C1SCC(=O)NCC2=CC(=C(C=C2)OCC3=CC=CC=C3)OC

InChI

InChI=1S/C20H22N4O3S/c1-24-14-22-23-20(24)28-13-19(25)21-11-16-8-9-17(18(10-16)26-2)27-12-15-6-4-3-5-7-15/h3-10,14H,11-13H2,1-2H3,(H,21,25)