N-(2-methoxy-5-methyl-phenyl)-2-[[4-(2-methylprop-2-enyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-2-[[4-(2-methylprop-2-enyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(2-methoxy-5-methyl-phenyl)-2-[[4-(2-methylallyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-methoxy-5-methylphenyl)-2-[[4-(2-methylprop-2-enyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-methoxy-5-methylphenyl)-2-[[4-(2-methylprop-2-enyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(2-methoxy-5-methyl-phenyl)-2-[[4-(2-methylallyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)CSC2=NN=C(N2CC(=C)C)C3=CC=NC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)CSC2=NN=C(N2CC(=C)C)C3=CC=NC=C3

InChI

InChI=1S/C21H23N5O2S/c1-14(2)12-26-20(16-7-9-22-10-8-16)24-25-21(26)29-13-19(27)23-17-11-15(3)5-6-18(17)28-4/h5-11H,1,12-13H2,2-4H3,(H,23,27)