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

Systemtic Name: 2-[[4-azanyl-5-[(4-chloranylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentyl-ethanamide Openeye Name: 2-[[4-amino-5-[(4-chlorophenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentyl-acetamide CAS Name: 2-[[4-amino-5-[(4-chlorophenoxy)methyl]-1,2,4-triazol-3-yl]thio]-N-cyclopentylacetamide IUPAC Name: 2-[[4-amino-5-[(4-chlorophenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentylacetamide Traditional Name: 2-[[4-amino-5-[(4-chlorophenoxy)methyl]-1,2,4-triazol-3-yl]thio]-N-cyclopentyl-acetamide Formula: C16H20ClN5O2S MolecularWeight: 381.8803

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)CSC2=NN=C(N2N)COC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCC(C1)NC(=O)CSC2=NN=C(N2N)COC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H20ClN5O2S/c17-11-5-7-13(8-6-11)24-9-14-20-21-16(22(14)18)25-10-15(23)19-12-3-1-2-4-12/h5-8,12H,1-4,9-10,18H2,(H,19,23)