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

Systemtic Name: N2-(3-chloranyl-4-propan-2-yloxy-phenyl)-N2-cycloheptyl-N4-methyl-N4-(1-methylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine Openeye Name: N2-(3-chloro-4-isopropoxy-phenyl)-N2-cycloheptyl-N4-methyl-N4-(1-methyl-4-piperidyl)-1,3,5-triazine-2,4,6-triamine CAS Name: N2-(3-chloro-4-propan-2-yloxyphenyl)-N2-cycloheptyl-N4-methyl-N4-(1-methyl-4-piperidinyl)-1,3,5-triazine-2,4,6-triamine IUPAC Name: 2-N-(3-chloro-4-propan-2-yloxyphenyl)-2-N-cycloheptyl-4-N-methyl-4-N-(1-methylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine Traditional Name: [4-amino-6-(3-chloro-N-cycloheptyl-4-isopropoxy-anilino)-s-triazin-2-yl]-methyl-(1-methyl-4-piperidyl)amine Formula: C26H40ClN7O MolecularWeight: 502.0951

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)N(C2CCCCCC2)C3=NC(=NC(=N3)N)N(C)C4CCN(CC4)C)Cl

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)N(C2CCCCCC2)C3=NC(=NC(=N3)N)N(C)C4CCN(CC4)C)Cl

InChI

InChI=1S/C26H40ClN7O/c1-18(2)35-23-12-11-21(17-22(23)27)34(20-9-7-5-6-8-10-20)26-30-24(28)29-25(31-26)33(4)19-13-15-32(3)16-14-19/h11-12,17-20H,5-10,13-16H2,1-4H3,(H2,28,29,30,31)