8-ethyl-5-oxidanylidene-2-[4-[(4-pyrazol-1-ylphenyl)carbamothioyl]piperazin-1-yl]pyrido[2,3-d]pyrimidine-6-carboxylic acid

Systemtic Name: 8-ethyl-5-oxidanylidene-2-[4-[(4-pyrazol-1-ylphenyl)carbamothioyl]piperazin-1-yl]pyrido[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 8-ethyl-5-oxo-2-[4-[(4-pyrazol-1-ylphenyl)carbamothioyl]piperazin-1-yl]pyrido[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 8-ethyl-5-oxo-2-[4-[[4-(1-pyrazolyl)anilino]-sulfanylidenemethyl]-1-piperazinyl]-6-pyrido[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 8-ethyl-5-oxo-2-[4-[(4-pyrazol-1-ylphenyl)carbamothioyl]piperazin-1-yl]pyrido[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 8-ethyl-5-keto-2-[4-[(4-pyrazol-1-ylphenyl)thiocarbamoyl]piperazino]pyrido[2,3-d]pyrimidine-6-carboxylic acid Formula: C24H24N8O3S MolecularWeight: 504.56416

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCN(CC3)C(=S)NC4=CC=C(C=C4)N5C=CC=N5)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCN(CC3)C(=S)NC4=CC=C(C=C4)N5C=CC=N5)C(=O)O

InChI

InChI=1S/C24H24N8O3S/c1-2-29-15-19(22(34)35)20(33)18-14-25-23(28-21(18)29)30-10-12-31(13-11-30)24(36)27-16-4-6-17(7-5-16)32-9-3-8-26-32/h3-9,14-15H,2,10-13H2,1H3,(H,27,36)(H,34,35)