2-[4-[5-[[(4-chlorophenyl)carbonylamino]methyl]thiophen-2-yl]sulfonylpiperazin-1-yl]-8-ethyl-5-oxidanylidene-pyrido[2,3-d]pyrimidine-6-carboxylic acid

Systemtic Name: 2-[4-[5-[[(4-chlorophenyl)carbonylamino]methyl]thiophen-2-yl]sulfonylpiperazin-1-yl]-8-ethyl-5-oxidanylidene-pyrido[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 2-[4-[[5-[[(4-chlorobenzoyl)amino]methyl]-2-thienyl]sulfonyl]piperazin-1-yl]-8-ethyl-5-oxo-pyrido[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 2-[4-[[5-[[[(4-chlorophenyl)-oxomethyl]amino]methyl]-2-thiophenyl]sulfonyl]-1-piperazinyl]-8-ethyl-5-oxo-6-pyrido[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 2-[4-[5-[[(4-chlorobenzoyl)amino]methyl]thiophen-2-yl]sulfonylpiperazin-1-yl]-8-ethyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 2-[4-[[5-[[(4-chlorobenzoyl)amino]methyl]-2-thienyl]sulfonyl]piperazino]-8-ethyl-5-keto-pyrido[2,3-d]pyrimidine-6-carboxylic acid Formula: C26H25ClN6O6S2 MolecularWeight: 617.0963

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCN(CC3)S(=O)(=O)C4=CC=C(S4)CNC(=O)C5=CC=C(C=C5)Cl)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCN(CC3)S(=O)(=O)C4=CC=C(S4)CNC(=O)C5=CC=C(C=C5)Cl)C(=O)O

InChI

InChI=1S/C26H25ClN6O6S2/c1-2-31-15-20(25(36)37)22(34)19-14-29-26(30-23(19)31)32-9-11-33(12-10-32)41(38,39)21-8-7-18(40-21)13-28-24(35)16-3-5-17(27)6-4-16/h3-8,14-15H,2,9-13H2,1H3,(H,28,35)(H,36,37)