4-methoxy-N-[2-[[4-(2-methoxyethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]benzamide

Systemtic Name: 4-methoxy-N-[2-[[4-(2-methoxyethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]benzamide Openeye Name: 4-methoxy-N-[2-[[4-(2-methoxyethyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]benzamide CAS Name: 4-methoxy-N-[2-[[4-(2-methoxyethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]-1-oxoethyl]benzamide IUPAC Name: 4-methoxy-N-[2-[[4-(2-methoxyethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetyl]benzamide Traditional Name: 4-methoxy-N-[2-[[4-(2-methoxyethyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetyl]benzamide Formula: C20H21N5O4S MolecularWeight: 427.47684

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=NN=C1SCC(=O)NC(=O)C2=CC=C(C=C2)OC)C3=CC=NC=C3

Isomeric SMILES

COCCN1C(=NN=C1SCC(=O)NC(=O)C2=CC=C(C=C2)OC)C3=CC=NC=C3

InChI

InChI=1S/C20H21N5O4S/c1-28-12-11-25-18(14-7-9-21-10-8-14)23-24-20(25)30-13-17(26)22-19(27)15-3-5-16(29-2)6-4-15/h3-10H,11-13H2,1-2H3,(H,22,26,27)