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

Systemtic Name: N2-(2-ethylphenyl)-6-(quinazolin-4-ylsulfanylmethyl)-1,3,5-triazine-2,4-diamine Openeye Name: N2-(2-ethylphenyl)-6-(quinazolin-4-ylsulfanylmethyl)-1,3,5-triazine-2,4-diamine CAS Name: N2-(2-ethylphenyl)-6-[(4-quinazolinylthio)methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(2-ethylphenyl)-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-ethylphenyl)amine Formula: C20H19N7S MolecularWeight: 389.47676

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSC3=NC=NC4=CC=CC=C43

Isomeric SMILES

CCC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSC3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C20H19N7S/c1-2-13-7-3-5-9-15(13)24-20-26-17(25-19(21)27-20)11-28-18-14-8-4-6-10-16(14)22-12-23-18/h3-10,12H,2,11H2,1H3,(H3,21,24,25,26,27)