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

Systemtic Name: N-[2-[[4-ethyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]-2-methoxy-benzamide Openeye Name: N-[2-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-2-methoxy-benzamide CAS Name: N-[2-[[4-ethyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-2-methoxybenzamide IUPAC Name: N-[2-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-2-methoxybenzamide Traditional Name: N-[2-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)thio]acetyl]-2-methoxy-benzamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC(=O)C2=CC=CC=C2OC)CC3=CC=CC=C3

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC(=O)C2=CC=CC=C2OC)CC3=CC=CC=C3

InChI

InChI=1S/C21H22N4O3S/c1-3-25-18(13-15-9-5-4-6-10-15)23-24-21(25)29-14-19(26)22-20(27)16-11-7-8-12-17(16)28-2/h4-12H,3,13-14H2,1-2H3,(H,22,26,27)