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

Systemtic Name: 6-[(6-chloranyl-4-phenyl-quinazolin-2-yl)sulfanylmethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(6-chloro-4-phenyl-quinazolin-2-yl)sulfanylmethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine CAS Name: 6-[[(6-chloro-4-phenyl-2-quinazolinyl)thio]methyl]-N2-phenyl-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(6-chloro-4-phenylquinazolin-2-yl)sulfanylmethyl]-2-N-phenyl-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(6-chloro-4-phenyl-quinazolin-2-yl)thio]methyl]-s-triazin-2-yl]-phenyl-amine Formula: C24H18ClN7S MolecularWeight: 471.96462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Cl)SCC4=NC(=NC(=N4)NC5=CC=CC=C5)N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Cl)SCC4=NC(=NC(=N4)NC5=CC=CC=C5)N

InChI

InChI=1S/C24H18ClN7S/c25-16-11-12-19-18(13-16)21(15-7-3-1-4-8-15)31-24(28-19)33-14-20-29-22(26)32-23(30-20)27-17-9-5-2-6-10-17/h1-13H,14H2,(H3,26,27,29,30,32)