1-phenethyl-3-[4-[(3,4,5-trimethoxyphenyl)amino]-1,3,5-triazin-2-yl]urea

Systemtic Name: 1-phenethyl-3-[4-[(3,4,5-trimethoxyphenyl)amino]-1,3,5-triazin-2-yl]urea Openeye Name: 1-phenethyl-3-[4-(3,4,5-trimethoxyanilino)-1,3,5-triazin-2-yl]urea CAS Name: 1-phenethyl-3-[4-(3,4,5-trimethoxyanilino)-1,3,5-triazin-2-yl]urea IUPAC Name: 1-phenethyl-3-[4-(3,4,5-trimethoxyanilino)-1,3,5-triazin-2-yl]urea Traditional Name: 1-phenethyl-3-[4-(3,4,5-trimethoxyanilino)-s-triazin-2-yl]urea Formula: C21H24N6O4 MolecularWeight: 424.45306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC2=NC(=NC=N2)NC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC2=NC(=NC=N2)NC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C21H24N6O4/c1-29-16-11-15(12-17(30-2)18(16)31-3)25-19-23-13-24-20(26-19)27-21(28)22-10-9-14-7-5-4-6-8-14/h4-8,11-13H,9-10H2,1-3H3,(H3,22,23,24,25,26,27,28)