6-[1-(1-methyl-5-phenyl-imidazol-2-yl)sulfanylethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[1-(1-methyl-5-phenyl-imidazol-2-yl)sulfanylethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine Openeye Name: 6-[1-(1-methyl-5-phenyl-imidazol-2-yl)sulfanylethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine CAS Name: 6-[1-[(1-methyl-5-phenyl-2-imidazolyl)thio]ethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[1-(1-methyl-5-phenylimidazol-2-yl)sulfanylethyl]-2-N-phenyl-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[1-[(1-methyl-5-phenyl-imidazol-2-yl)thio]ethyl]-s-triazin-2-yl]-phenyl-amine Formula: C21H21N7S MolecularWeight: 403.50334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NC(=N1)NC2=CC=CC=C2)N)SC3=NC=C(N3C)C4=CC=CC=C4

Isomeric SMILES

CC(C1=NC(=NC(=N1)NC2=CC=CC=C2)N)SC3=NC=C(N3C)C4=CC=CC=C4

InChI

InChI=1S/C21H21N7S/c1-14(29-21-23-13-17(28(21)2)15-9-5-3-6-10-15)18-25-19(22)27-20(26-18)24-16-11-7-4-8-12-16/h3-14H,1-2H3,(H3,22,24,25,26,27)