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

Systemtic Name: 2-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2-chlorophenyl)methyl]ethanamide Openeye Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2-chlorophenyl)methyl]acetamide CAS Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-[(2-chlorophenyl)methyl]acetamide IUPAC Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2-chlorophenyl)methyl]acetamide Traditional Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-(2-chlorobenzyl)acetamide Formula: C14H16ClN5OS MolecularWeight: 337.82774

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2N)SCC(=O)NCC3=CC=CC=C3Cl

Isomeric SMILES

C1CC1C2=NN=C(N2N)SCC(=O)NCC3=CC=CC=C3Cl

InChI

InChI=1S/C14H16ClN5OS/c15-11-4-2-1-3-10(11)7-17-12(21)8-22-14-19-18-13(20(14)16)9-5-6-9/h1-4,9H,5-8,16H2,(H,17,21)