2-[(4-azanyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(2-methoxyphenoxy)ethyl]ethanamide

Systemtic Name: 2-[(4-azanyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(2-methoxyphenoxy)ethyl]ethanamide Openeye Name: 2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[2-(2-methoxyphenoxy)ethyl]acetamide CAS Name: 2-[[4-amino-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-N-[2-(2-methoxyphenoxy)ethyl]acetamide IUPAC Name: 2-[(4-amino-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(2-methoxyphenoxy)ethyl]acetamide Traditional Name: 2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-[2-(2-methoxyphenoxy)ethyl]acetamide Formula: C18H20N6O3S MolecularWeight: 400.4548

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCCNC(=O)CSC2=NN=C(N2N)C3=CN=CC=C3

Isomeric SMILES

COC1=CC=CC=C1OCCNC(=O)CSC2=NN=C(N2N)C3=CN=CC=C3

InChI

InChI=1S/C18H20N6O3S/c1-26-14-6-2-3-7-15(14)27-10-9-21-16(25)12-28-18-23-22-17(24(18)19)13-5-4-8-20-11-13/h2-8,11H,9-10,12,19H2,1H3,(H,21,25)