2-[[4-butyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethyl-2-phenyl-ethanamide

Systemtic Name: 2-[[4-butyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethyl-2-phenyl-ethanamide Openeye Name: 2-[[4-butyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethyl-2-phenyl-acetamide CAS Name: 2-[[4-butyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N,N-diethyl-2-phenylacetamide IUPAC Name: 2-[[4-butyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethyl-2-phenylacetamide Traditional Name: 2-[[4-butyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N,N-diethyl-2-phenyl-acetamide Formula: C25H32N4O2S MolecularWeight: 452.61218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=C1SC(C2=CC=CC=C2)C(=O)N(CC)CC)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCCN1C(=NN=C1SC(C2=CC=CC=C2)C(=O)N(CC)CC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C25H32N4O2S/c1-5-8-18-29-23(20-14-16-21(31-4)17-15-20)26-27-25(29)32-22(19-12-10-9-11-13-19)24(30)28(6-2)7-3/h9-17,22H,5-8,18H2,1-4H3