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

Systemtic Name: N-[(4-methoxyphenyl)methyl]-2-[(4-propyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[(4-methoxyphenyl)methyl]-2-[[4-propyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-[(4-methoxyphenyl)methyl]-2-[[4-propyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-2-[(4-propyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-p-anisyl-2-[[4-propyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C20H23N5O2S MolecularWeight: 397.49392

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCC(=O)NCC2=CC=C(C=C2)OC)C3=CN=CC=C3

Isomeric SMILES

CCCN1C(=NN=C1SCC(=O)NCC2=CC=C(C=C2)OC)C3=CN=CC=C3

InChI

InChI=1S/C20H23N5O2S/c1-3-11-25-19(16-5-4-10-21-13-16)23-24-20(25)28-14-18(26)22-12-15-6-8-17(27-2)9-7-15/h4-10,13H,3,11-12,14H2,1-2H3,(H,22,26)