N-[(3,4-dimethoxyphenyl)methyl]-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-N-veratryl-acetamide Formula: C19H21N5O3S MolecularWeight: 399.46674

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N5O3S/c1-24-18(14-6-8-20-9-7-14)22-23-19(24)28-12-17(25)21-11-13-4-5-15(26-2)16(10-13)27-3/h4-10H,11-12H2,1-3H3,(H,21,25)