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

Systemtic Name: 2-[(4-azanyl-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-naphthalen-2-yl-ethanamide Openeye Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-naphthyl)acetamide CAS Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)thio]-N-(2-naphthalenyl)acetamide IUPAC Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-naphthalen-2-ylacetamide Traditional Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)thio]-N-(2-naphthyl)acetamide Formula: C18H21N5OS MolecularWeight: 355.45724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(N1N)SCC(=O)NC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CCCCC1=NN=C(N1N)SCC(=O)NC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C18H21N5OS/c1-2-3-8-16-21-22-18(23(16)19)25-12-17(24)20-15-10-9-13-6-4-5-7-14(13)11-15/h4-7,9-11H,2-3,8,12,19H2,1H3,(H,20,24)