4-[[4-azanyl-6-(cyclohexylmethoxy)pyrimidin-2-yl]amino]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[[4-azanyl-6-(cyclohexylmethoxy)pyrimidin-2-yl]amino]-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[[4-amino-6-(cyclohexylmethoxy)pyrimidin-2-yl]amino]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[[4-amino-6-(cyclohexylmethoxy)-2-pyrimidinyl]amino]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[[4-amino-6-(cyclohexylmethoxy)pyrimidin-2-yl]amino]-N,N-diethylbenzenesulfonamide Traditional Name: 4-[[4-amino-6-(cyclohexylmethoxy)pyrimidin-2-yl]amino]-N,N-diethyl-benzenesulfonamide Formula: C21H31N5O3S MolecularWeight: 433.56754

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC2=NC(=CC(=N2)OCC3CCCCC3)N

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC2=NC(=CC(=N2)OCC3CCCCC3)N

InChI

InChI=1S/C21H31N5O3S/c1-3-26(4-2)30(27,28)18-12-10-17(11-13-18)23-21-24-19(22)14-20(25-21)29-15-16-8-6-5-7-9-16/h10-14,16H,3-9,15H2,1-2H3,(H3,22,23,24,25)