N-hexyl-2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-hexyl-2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-hexyl-2-[[4-isopropyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-hexyl-2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-hexyl-2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-hexyl-2-[[4-isopropyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C20H30N4O2S MolecularWeight: 390.5428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)CSC1=NN=C(N1C(C)C)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCCCCNC(=O)CSC1=NN=C(N1C(C)C)C2=CC=C(C=C2)OC

InChI

InChI=1S/C20H30N4O2S/c1-5-6-7-8-13-21-18(25)14-27-20-23-22-19(24(20)15(2)3)16-9-11-17(26-4)12-10-16/h9-12,15H,5-8,13-14H2,1-4H3,(H,21,25)