N4-(3-hexoxypropyl)-6-methylsulfanyl-N2-(2,4,4-trimethylcyclopentyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: N4-(3-hexoxypropyl)-6-methylsulfanyl-N2-(2,4,4-trimethylcyclopentyl)-1,3,5-triazine-2,4-diamine Openeye Name: N4-(3-hexoxypropyl)-6-methylsulfanyl-N2-(2,4,4-trimethylcyclopentyl)-1,3,5-triazine-2,4-diamine CAS Name: N4-(3-hexoxypropyl)-6-(methylthio)-N2-(2,4,4-trimethylcyclopentyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 4-N-(3-hexoxypropyl)-6-methylsulfanyl-2-N-(2,4,4-trimethylcyclopentyl)-1,3,5-triazine-2,4-diamine Traditional Name: 3-hexoxypropyl-[4-(methylthio)-6-[(2,4,4-trimethylcyclopentyl)amino]-s-triazin-2-yl]amine Formula: C21H39N5OS MolecularWeight: 409.63226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOCCCNC1=NC(=NC(=N1)NC2CC(CC2C)(C)C)SC

Isomeric SMILES

CCCCCCOCCCNC1=NC(=NC(=N1)NC2CC(CC2C)(C)C)SC

InChI

InChI=1S/C21H39N5OS/c1-6-7-8-9-12-27-13-10-11-22-18-24-19(26-20(25-18)28-5)23-17-15-21(3,4)14-16(17)2/h16-17H,6-15H2,1-5H3,(H2,22,23,24,25,26)