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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN=C(N1N)SCC(=O)NC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC(C)(C)C1=NN=C(N1N)SCC(=O)NC2=CC=CC3=CC=CC=C32

InChI

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