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

Systemtic Name: N4-(3-chloranyl-4-methoxy-phenyl)-N2-cycloheptyl-6-(oxolan-2-ylmethoxy)-1,3,5-triazine-2,4-diamine Openeye Name: N4-(3-chloro-4-methoxy-phenyl)-N2-cycloheptyl-6-(tetrahydrofuran-2-ylmethoxy)-1,3,5-triazine-2,4-diamine CAS Name: N4-(3-chloro-4-methoxyphenyl)-N2-cycloheptyl-6-(2-oxolanylmethoxy)-1,3,5-triazine-2,4-diamine IUPAC Name: 4-N-(3-chloro-4-methoxyphenyl)-2-N-cycloheptyl-6-(oxolan-2-ylmethoxy)-1,3,5-triazine-2,4-diamine Traditional Name: [4-(3-chloro-4-methoxy-anilino)-6-(tetrahydrofurfuryloxy)-s-triazin-2-yl]-cycloheptyl-amine Formula: C22H30ClN5O3 MolecularWeight: 447.9583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC(=NC(=N2)OCC3CCCO3)NC4CCCCCC4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC(=NC(=N2)OCC3CCCO3)NC4CCCCCC4)Cl

InChI

InChI=1S/C22H30ClN5O3/c1-29-19-11-10-16(13-18(19)23)25-21-26-20(24-15-7-4-2-3-5-8-15)27-22(28-21)31-14-17-9-6-12-30-17/h10-11,13,15,17H,2-9,12,14H2,1H3,(H2,24,25,26,27,28)