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

Systemtic Name: 2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2-chlorophenyl)methyl]ethanamide Openeye Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2-chlorophenyl)methyl]acetamide CAS Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N-[(2-chlorophenyl)methyl]acetamide IUPAC Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2-chlorophenyl)methyl]acetamide Traditional Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N-(2-chlorobenzyl)acetamide Formula: C17H22ClN5OS MolecularWeight: 379.90748

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN=C(N2N)SCC(=O)NCC3=CC=CC=C3Cl

Isomeric SMILES

C1CCC(CC1)C2=NN=C(N2N)SCC(=O)NCC3=CC=CC=C3Cl

InChI

InChI=1S/C17H22ClN5OS/c18-14-9-5-4-8-13(14)10-20-15(24)11-25-17-22-21-16(23(17)19)12-6-2-1-3-7-12/h4-5,8-9,12H,1-3,6-7,10-11,19H2,(H,20,24)