N2-(4-methylphenyl)-6-[(4-methylquinolin-2-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-(4-methylphenyl)-6-[(4-methylquinolin-2-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(4-methyl-2-quinolyl)sulfanylmethyl]-N2-(p-tolyl)-1,3,5-triazine-2,4-diamine CAS Name: N2-(4-methylphenyl)-6-[[(4-methyl-2-quinolinyl)thio]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(4-methylphenyl)-6-[(4-methylquinolin-2-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(4-methyl-2-quinolyl)thio]methyl]-s-triazin-2-yl]-(p-tolyl)amine Formula: C21H20N6S MolecularWeight: 388.4887

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSC3=NC4=CC=CC=C4C(=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSC3=NC4=CC=CC=C4C(=C3)C

InChI

InChI=1S/C21H20N6S/c1-13-7-9-15(10-8-13)23-21-26-18(25-20(22)27-21)12-28-19-11-14(2)16-5-3-4-6-17(16)24-19/h3-11H,12H2,1-2H3,(H3,22,23,25,26,27)