N-(6-methoxypyridin-3-yl)-2-[[4-(4-propan-2-ylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(6-methoxypyridin-3-yl)-2-[[4-(4-propan-2-ylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-(4-isopropylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(6-methoxy-3-pyridyl)acetamide CAS Name: N-(6-methoxy-3-pyridinyl)-2-[[4-(4-propan-2-ylphenyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(6-methoxypyridin-3-yl)-2-[[4-(4-propan-2-ylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(6-methoxy-3-pyridyl)-2-[(4-p-cumenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C19H21N5O2S MolecularWeight: 383.46734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C=NN=C2SCC(=O)NC3=CN=C(C=C3)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C=NN=C2SCC(=O)NC3=CN=C(C=C3)OC

InChI

InChI=1S/C19H21N5O2S/c1-13(2)14-4-7-16(8-5-14)24-12-21-23-19(24)27-11-17(25)22-15-6-9-18(26-3)20-10-15/h4-10,12-13H,11H2,1-3H3,(H,22,25)