N2-(2-methoxyphenyl)-6-(quinazolin-4-ylsulfanylmethyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-(2-methoxyphenyl)-6-(quinazolin-4-ylsulfanylmethyl)-1,3,5-triazine-2,4-diamine Openeye Name: N2-(2-methoxyphenyl)-6-(quinazolin-4-ylsulfanylmethyl)-1,3,5-triazine-2,4-diamine CAS Name: N2-(2-methoxyphenyl)-6-[(4-quinazolinylthio)methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(2-methoxyphenyl)-6-(quinazolin-4-ylsulfanylmethyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(quinazolin-4-ylthio)methyl]-s-triazin-2-yl]-(2-methoxyphenyl)amine Formula: C19H17N7OS MolecularWeight: 391.44958

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSC3=NC=NC4=CC=CC=C43

Isomeric SMILES

COC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSC3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C19H17N7OS/c1-27-15-9-5-4-8-14(15)23-19-25-16(24-18(20)26-19)10-28-17-12-6-2-3-7-13(12)21-11-22-17/h2-9,11H,10H2,1H3,(H3,20,23,24,25,26)