tert-butyl 2-(dimethylamino)-4-(4-methylphenyl)sulfonyloxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxylate

Systemtic Name: tert-butyl 2-(dimethylamino)-4-(4-methylphenyl)sulfonyloxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxylate Openeye Name: tert-butyl 2-(dimethylamino)-4-(p-tolylsulfonyloxy)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxylate CAS Name: 2-(dimethylamino)-4-(4-methylphenyl)sulfonyloxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(dimethylamino)-4-(4-methylphenyl)sulfonyloxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxylate Traditional Name: 2-(dimethylamino)-4-tosyloxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxylic acid tert-butyl ester Formula: C21H28N4O5S MolecularWeight: 448.53582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=NC(=NC3=C2CN(CC3)C(=O)OC(C)(C)C)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=NC(=NC3=C2CN(CC3)C(=O)OC(C)(C)C)N(C)C

InChI

InChI=1S/C21H28N4O5S/c1-14-7-9-15(10-8-14)31(27,28)30-18-16-13-25(20(26)29-21(2,3)4)12-11-17(16)22-19(23-18)24(5)6/h7-10H,11-13H2,1-6H3