N-butyl-2-[[4-(3-methylbutyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-butyl-2-[[4-(3-methylbutyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-butyl-2-[[4-isopentyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-butyl-2-[[4-(3-methylbutyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-butyl-2-[[4-(3-methylbutyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-butyl-2-[[4-isoamyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C20H30N4O2S MolecularWeight: 390.5428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CSC1=NN=C(N1CCC(C)C)COC2=CC=CC=C2

Isomeric SMILES

CCCCNC(=O)CSC1=NN=C(N1CCC(C)C)COC2=CC=CC=C2

InChI

InChI=1S/C20H30N4O2S/c1-4-5-12-21-19(25)15-27-20-23-22-18(24(20)13-11-16(2)3)14-26-17-9-7-6-8-10-17/h6-10,16H,4-5,11-15H2,1-3H3,(H,21,25)