2-[[4-(dimethylamino)-6-[(phenylmethyl)amino]-1,3,5-triazin-2-yl]sulfanyl]-N-phenyl-ethanamide

Systemtic Name: 2-[[4-(dimethylamino)-6-[(phenylmethyl)amino]-1,3,5-triazin-2-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[[4-(benzylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]sulfanyl]-N-phenyl-acetamide CAS Name: 2-[[4-(dimethylamino)-6-[(phenylmethyl)amino]-1,3,5-triazin-2-yl]thio]-N-phenylacetamide IUPAC Name: 2-[[4-(benzylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]sulfanyl]-N-phenylacetamide Traditional Name: 2-[[4-(benzylamino)-6-(dimethylamino)-s-triazin-2-yl]thio]-N-phenyl-acetamide Formula: C20H22N6OS MolecularWeight: 394.49328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC(=N1)NCC2=CC=CC=C2)SCC(=O)NC3=CC=CC=C3

Isomeric SMILES

CN(C)C1=NC(=NC(=N1)NCC2=CC=CC=C2)SCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H22N6OS/c1-26(2)19-23-18(21-13-15-9-5-3-6-10-15)24-20(25-19)28-14-17(27)22-16-11-7-4-8-12-16/h3-12H,13-14H2,1-2H3,(H,22,27)(H,21,23,24,25)