4-[[4-azanyl-6-(cyclohexylmethoxy)-5-nitroso-pyrimidin-2-yl]amino]-N-(oxolan-2-ylmethyl)benzenesulfonamide

Systemtic Name: 4-[[4-azanyl-6-(cyclohexylmethoxy)-5-nitroso-pyrimidin-2-yl]amino]-N-(oxolan-2-ylmethyl)benzenesulfonamide Openeye Name: 4-[[4-amino-6-(cyclohexylmethoxy)-5-nitroso-pyrimidin-2-yl]amino]-N-(tetrahydrofuran-2-ylmethyl)benzenesulfonamide CAS Name: 4-[[4-amino-6-(cyclohexylmethoxy)-5-nitroso-2-pyrimidinyl]amino]-N-(2-oxolanylmethyl)benzenesulfonamide IUPAC Name: 4-[[4-amino-6-(cyclohexylmethoxy)-5-nitrosopyrimidin-2-yl]amino]-N-(oxolan-2-ylmethyl)benzenesulfonamide Traditional Name: 4-[[4-amino-6-(cyclohexylmethoxy)-5-nitroso-pyrimidin-2-yl]amino]-N-(tetrahydrofurfuryl)benzenesulfonamide Formula: C22H30N6O5S MolecularWeight: 490.5758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)COC2=NC(=NC(=C2N=O)N)NC3=CC=C(C=C3)S(=O)(=O)NCC4CCCO4

Isomeric SMILES

C1CCC(CC1)COC2=NC(=NC(=C2N=O)N)NC3=CC=C(C=C3)S(=O)(=O)NCC4CCCO4

InChI

InChI=1S/C22H30N6O5S/c23-20-19(28-29)21(33-14-15-5-2-1-3-6-15)27-22(26-20)25-16-8-10-18(11-9-16)34(30,31)24-13-17-7-4-12-32-17/h8-11,15,17,24H,1-7,12-14H2,(H3,23,25,26,27)