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

Systemtic Name: 6-[(2-methylquinazolin-4-yl)sulfanylmethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(2-methylquinazolin-4-yl)sulfanylmethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine CAS Name: 6-[[(2-methyl-4-quinazolinyl)thio]methyl]-N2-phenyl-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(2-methylquinazolin-4-yl)sulfanylmethyl]-2-N-phenyl-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(2-methylquinazolin-4-yl)thio]methyl]-s-triazin-2-yl]-phenyl-amine Formula: C19H17N7S MolecularWeight: 375.45018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SCC3=NC(=NC(=N3)NC4=CC=CC=C4)N

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)SCC3=NC(=NC(=N3)NC4=CC=CC=C4)N

InChI

InChI=1S/C19H17N7S/c1-12-21-15-10-6-5-9-14(15)17(22-12)27-11-16-24-18(20)26-19(25-16)23-13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H3,20,23,24,25,26)