3-cyclohexyl-N5-[2-(2,3,4-trimethylphenyl)propan-2-yl]quinoline-2,4,5-triamine

Systemtic Name: 3-cyclohexyl-N5-[2-(2,3,4-trimethylphenyl)propan-2-yl]quinoline-2,4,5-triamine Openeye Name: 3-cyclohexyl-N5-[1-methyl-1-(2,3,4-trimethylphenyl)ethyl]quinoline-2,4,5-triamine CAS Name: 3-cyclohexyl-N5-[2-(2,3,4-trimethylphenyl)propan-2-yl]quinoline-2,4,5-triamine IUPAC Name: 3-cyclohexyl-5-N-[2-(2,3,4-trimethylphenyl)propan-2-yl]quinoline-2,4,5-triamine Traditional Name: (2,4-diamino-3-cyclohexyl-5-quinolyl)-[1-methyl-1-(2,3,4-trimethylphenyl)ethyl]amine Formula: C27H36N4 MolecularWeight: 416.60154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(C)(C)NC2=CC=CC3=C2C(=C(C(=N3)N)C4CCCCC4)N)C)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C(C)(C)NC2=CC=CC3=C2C(=C(C(=N3)N)C4CCCCC4)N)C)C

InChI

InChI=1S/C27H36N4/c1-16-14-15-20(18(3)17(16)2)27(4,5)31-22-13-9-12-21-24(22)25(28)23(26(29)30-21)19-10-7-6-8-11-19/h9,12-15,19,31H,6-8,10-11H2,1-5H3,(H4,28,29,30)