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

Systemtic Name: N6-(3-chloranyl-4-phenylmethoxy-phenyl)-N4-cycloheptyl-N2-methyl-N2-(1-methylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine Openeye Name: N6-(4-benzyloxy-3-chloro-phenyl)-N4-cycloheptyl-N2-methyl-N2-(1-methyl-4-piperidyl)-1,3,5-triazine-2,4,6-triamine CAS Name: N6-(3-chloro-4-phenylmethoxyphenyl)-N4-cycloheptyl-N2-methyl-N2-(1-methyl-4-piperidinyl)-1,3,5-triazine-2,4,6-triamine IUPAC Name: 6-N-(3-chloro-4-phenylmethoxyphenyl)-4-N-cycloheptyl-2-N-methyl-2-N-(1-methylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine Traditional Name: [4-(4-benzoxy-3-chloro-anilino)-6-(cycloheptylamino)-s-triazin-2-yl]-methyl-(1-methyl-4-piperidyl)amine Formula: C30H40ClN7O MolecularWeight: 550.1379

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N(C)C2=NC(=NC(=N2)NC3CCCCCC3)NC4=CC(=C(C=C4)OCC5=CC=CC=C5)Cl

Isomeric SMILES

CN1CCC(CC1)N(C)C2=NC(=NC(=N2)NC3CCCCCC3)NC4=CC(=C(C=C4)OCC5=CC=CC=C5)Cl

InChI

InChI=1S/C30H40ClN7O/c1-37-18-16-25(17-19-37)38(2)30-35-28(32-23-12-8-3-4-9-13-23)34-29(36-30)33-24-14-15-27(26(31)20-24)39-21-22-10-6-5-7-11-22/h5-7,10-11,14-15,20,23,25H,3-4,8-9,12-13,16-19,21H2,1-2H3,(H2,32,33,34,35,36)