2-[(4-azanyl-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[(4-azanyl-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylmethyl)ethanamide Openeye Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-benzyl-acetamide CAS Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)thio]-N-(phenylmethyl)acetamide IUPAC Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-benzylacetamide Traditional Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)thio]-N-benzyl-acetamide Formula: C15H21N5OS MolecularWeight: 319.42514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(N1N)SCC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CCCCC1=NN=C(N1N)SCC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C15H21N5OS/c1-2-3-9-13-18-19-15(20(13)16)22-11-14(21)17-10-12-7-5-4-6-8-12/h4-8H,2-3,9-11,16H2,1H3,(H,17,21)