2-[[4-azanyl-5-[(3-methoxyphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N,N-dicyclohexyl-ethanamide

Systemtic Name: 2-[[4-azanyl-5-[(3-methoxyphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N,N-dicyclohexyl-ethanamide Openeye Name: 2-[[4-amino-5-[(3-methoxyphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N,N-dicyclohexyl-acetamide CAS Name: 2-[[4-amino-5-[(3-methoxyphenoxy)methyl]-1,2,4-triazol-3-yl]thio]-N,N-dicyclohexylacetamide IUPAC Name: 2-[[4-amino-5-[(3-methoxyphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N,N-dicyclohexylacetamide Traditional Name: 2-[[4-amino-5-[(3-methoxyphenoxy)methyl]-1,2,4-triazol-3-yl]thio]-N,N-dicyclohexyl-acetamide Formula: C24H35N5O3S MolecularWeight: 473.6314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)OCC2=NN=C(N2N)SCC(=O)N(C3CCCCC3)C4CCCCC4

Isomeric SMILES

COC1=CC(=CC=C1)OCC2=NN=C(N2N)SCC(=O)N(C3CCCCC3)C4CCCCC4

InChI

InChI=1S/C24H35N5O3S/c1-31-20-13-8-14-21(15-20)32-16-22-26-27-24(29(22)25)33-17-23(30)28(18-9-4-2-5-10-18)19-11-6-3-7-12-19/h8,13-15,18-19H,2-7,9-12,16-17,25H2,1H3