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

Systemtic Name: 2-[(4-azanyl-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-N-propan-2-yl-ethanamide Openeye Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-isopropyl-N-phenyl-acetamide CAS Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)thio]-N-phenyl-N-propan-2-ylacetamide IUPAC Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-N-propan-2-ylacetamide Traditional Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)thio]-N-isopropyl-N-phenyl-acetamide Formula: C17H25N5OS MolecularWeight: 347.4783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25N5OS/c1-4-5-11-15-19-20-17(22(15)18)24-12-16(23)21(13(2)3)14-9-7-6-8-10-14/h6-10,13H,4-5,11-12,18H2,1-3H3