N6-(3-bromanyl-2-methoxy-phenyl)-N4-cycloheptyl-N2-methyl-N2-(1-methylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine

Systemtic Name: N6-(3-bromanyl-2-methoxy-phenyl)-N4-cycloheptyl-N2-methyl-N2-(1-methylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine Openeye Name: N6-(3-bromo-2-methoxy-phenyl)-N4-cycloheptyl-N2-methyl-N2-(1-methyl-4-piperidyl)-1,3,5-triazine-2,4,6-triamine CAS Name: N6-(3-bromo-2-methoxyphenyl)-N4-cycloheptyl-N2-methyl-N2-(1-methyl-4-piperidinyl)-1,3,5-triazine-2,4,6-triamine IUPAC Name: 6-N-(3-bromo-2-methoxyphenyl)-4-N-cycloheptyl-2-N-methyl-2-N-(1-methylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine Traditional Name: [4-(3-bromo-2-methoxy-anilino)-6-(cycloheptylamino)-s-triazin-2-yl]-methyl-(1-methyl-4-piperidyl)amine Formula: C24H36BrN7O MolecularWeight: 518.49294

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N(C)C2=NC(=NC(=N2)NC3CCCCCC3)NC4=C(C(=CC=C4)Br)OC

Isomeric SMILES

CN1CCC(CC1)N(C)C2=NC(=NC(=N2)NC3CCCCCC3)NC4=C(C(=CC=C4)Br)OC

InChI

InChI=1S/C24H36BrN7O/c1-31-15-13-18(14-16-31)32(2)24-29-22(26-17-9-6-4-5-7-10-17)28-23(30-24)27-20-12-8-11-19(25)21(20)33-3/h8,11-12,17-18H,4-7,9-10,13-16H2,1-3H3,(H2,26,27,28,29,30)