ethyl 2-(4-methylpiperazin-1-yl)-8-(2-methylsulfonyloxyethyl)-5-oxidanylidene-pyrido[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 2-(4-methylpiperazin-1-yl)-8-(2-methylsulfonyloxyethyl)-5-oxidanylidene-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2-(4-methylpiperazin-1-yl)-8-(2-methylsulfonyloxyethyl)-5-oxo-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-(4-methyl-1-piperazinyl)-8-(2-methylsulfonyloxyethyl)-5-oxo-6-pyrido[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-methylpiperazin-1-yl)-8-(2-methylsulfonyloxyethyl)-5-oxopyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-keto-2-(4-methylpiperazino)-8-(2-methylsulfonyloxyethyl)pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C18H25N5O6S MolecularWeight: 439.486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=NC(=NC=C2C1=O)N3CCN(CC3)C)CCOS(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=NC(=NC=C2C1=O)N3CCN(CC3)C)CCOS(=O)(=O)C

InChI

InChI=1S/C18H25N5O6S/c1-4-28-17(25)14-12-23(9-10-29-30(3,26)27)16-13(15(14)24)11-19-18(20-16)22-7-5-21(2)6-8-22/h11-12H,4-10H2,1-3H3