N,N-dimethyl-1-(5-phenyl-1,2,4-triazin-3-yl)hex-5-yne-1-sulfonamide

Systemtic Name: N,N-dimethyl-1-(5-phenyl-1,2,4-triazin-3-yl)hex-5-yne-1-sulfonamide Openeye Name: N,N-dimethyl-1-(5-phenyl-1,2,4-triazin-3-yl)hex-5-yne-1-sulfonamide CAS Name: N,N-dimethyl-1-(5-phenyl-1,2,4-triazin-3-yl)-5-hexyne-1-sulfonamide IUPAC Name: N,N-dimethyl-1-(5-phenyl-1,2,4-triazin-3-yl)hex-5-yne-1-sulfonamide Traditional Name: N,N-dimethyl-1-(5-phenyl-1,2,4-triazin-3-yl)hex-5-yne-1-sulfonamide Formula: C17H20N4O2S MolecularWeight: 344.4313

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C(CCCC#C)C1=NC(=CN=N1)C2=CC=CC=C2

Isomeric SMILES

CN(C)S(=O)(=O)C(CCCC#C)C1=NC(=CN=N1)C2=CC=CC=C2

InChI

InChI=1S/C17H20N4O2S/c1-4-5-7-12-16(24(22,23)21(2)3)17-19-15(13-18-20-17)14-10-8-6-9-11-14/h1,6,8-11,13,16H,5,7,12H2,2-3H3