2-[[4-azanyl-5-[(2,4-dimethylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-ethyl-N-naphthalen-1-yl-ethanamide

Systemtic Name: 2-[[4-azanyl-5-[(2,4-dimethylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-ethyl-N-naphthalen-1-yl-ethanamide Openeye Name: 2-[[4-amino-5-[(2,4-dimethylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-ethyl-N-(1-naphthyl)acetamide CAS Name: 2-[[4-amino-5-[(2,4-dimethylphenoxy)methyl]-1,2,4-triazol-3-yl]thio]-N-ethyl-N-(1-naphthalenyl)acetamide IUPAC Name: 2-[[4-amino-5-[(2,4-dimethylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-ethyl-N-naphthalen-1-ylacetamide Traditional Name: 2-[[4-amino-5-[(2,4-dimethylphenoxy)methyl]-1,2,4-triazol-3-yl]thio]-N-ethyl-N-(1-naphthyl)acetamide Formula: C25H27N5O2S MolecularWeight: 461.57918

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC2=CC=CC=C21)C(=O)CSC3=NN=C(N3N)COC4=C(C=C(C=C4)C)C

Isomeric SMILES

CCN(C1=CC=CC2=CC=CC=C21)C(=O)CSC3=NN=C(N3N)COC4=C(C=C(C=C4)C)C

InChI

InChI=1S/C25H27N5O2S/c1-4-29(21-11-7-9-19-8-5-6-10-20(19)21)24(31)16-33-25-28-27-23(30(25)26)15-32-22-13-12-17(2)14-18(22)3/h5-14H,4,15-16,26H2,1-3H3