N4-(3-chloranyl-4-methoxy-phenyl)-N2-cycloheptyl-6-pyrrolidin-2-yloxy-1,3,5-triazine-2,4-diamine

Systemtic Name: N4-(3-chloranyl-4-methoxy-phenyl)-N2-cycloheptyl-6-pyrrolidin-2-yloxy-1,3,5-triazine-2,4-diamine Openeye Name: N4-(3-chloro-4-methoxy-phenyl)-N2-cycloheptyl-6-pyrrolidin-2-yloxy-1,3,5-triazine-2,4-diamine CAS Name: N4-(3-chloro-4-methoxyphenyl)-N2-cycloheptyl-6-(2-pyrrolidinyloxy)-1,3,5-triazine-2,4-diamine IUPAC Name: 4-N-(3-chloro-4-methoxyphenyl)-2-N-cycloheptyl-6-pyrrolidin-2-yloxy-1,3,5-triazine-2,4-diamine Traditional Name: [4-(3-chloro-4-methoxy-anilino)-6-pyrrolidin-2-yloxy-s-triazin-2-yl]-cycloheptyl-amine Formula: C21H29ClN6O2 MolecularWeight: 432.94696

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC(=NC(=N2)OC3CCCN3)NC4CCCCCC4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC(=NC(=N2)OC3CCCN3)NC4CCCCCC4)Cl

InChI

InChI=1S/C21H29ClN6O2/c1-29-17-11-10-15(13-16(17)22)25-20-26-19(24-14-7-4-2-3-5-8-14)27-21(28-20)30-18-9-6-12-23-18/h10-11,13-14,18,23H,2-9,12H2,1H3,(H2,24,25,26,27,28)