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

Systemtic Name: 2-[[4-azanyl-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-cycloheptyl-ethanamide Openeye Name: 2-[[4-amino-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-cycloheptyl-acetamide CAS Name: 2-[[4-amino-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-3-yl]thio]-N-cycloheptylacetamide IUPAC Name: 2-[[4-amino-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-cycloheptylacetamide Traditional Name: 2-[(4-amino-5-p-anisyl-1,2,4-triazol-3-yl)thio]-N-cycloheptyl-acetamide Formula: C19H27N5O2S MolecularWeight: 389.51498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NN=C(N2N)SCC(=O)NC3CCCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NN=C(N2N)SCC(=O)NC3CCCCCC3

InChI

InChI=1S/C19H27N5O2S/c1-26-16-10-8-14(9-11-16)12-17-22-23-19(24(17)20)27-13-18(25)21-15-6-4-2-3-5-7-15/h8-11,15H,2-7,12-13,20H2,1H3,(H,21,25)