8-ethyl-2-[4-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)carbonylcarbamothioyl]piperazin-1-yl]-5-oxidanylidene-pyrido[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 8-ethyl-2-[4-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)carbonylcarbamothioyl]piperazin-1-yl]-5-oxidanylidene-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: 8-ethyl-2-[4-[(5-methyl-3-phenyl-isoxazole-4-carbonyl)carbamothioyl]piperazin-1-yl]-5-oxo-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 8-ethyl-2-[4-[[[(5-methyl-3-phenyl-4-isoxazolyl)-oxomethyl]amino]-sulfanylidenemethyl]-1-piperazinyl]-5-oxo-6-pyrido[2,3-d]pyrimidinecarboxylate IUPAC Name: 8-ethyl-2-[4-[(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)carbamothioyl]piperazin-1-yl]-5-oxopyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 8-ethyl-5-keto-2-[4-[(5-methyl-3-phenyl-isoxazole-4-carbonyl)thiocarbamoyl]piperazino]pyrido[2,3-d]pyrimidine-6-carboxylate Formula: C26H24N7O5S- MolecularWeight: 546.57766

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCN(CC3)C(=S)NC(=O)C4=C(ON=C4C5=CC=CC=C5)C)C(=O)[O-]

Isomeric SMILES

CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCN(CC3)C(=S)NC(=O)C4=C(ON=C4C5=CC=CC=C5)C)C(=O)[O-]

InChI

InChI=1S/C26H25N7O5S/c1-3-31-14-18(24(36)37)21(34)17-13-27-25(28-22(17)31)32-9-11-33(12-10-32)26(39)29-23(35)19-15(2)38-30-20(19)16-7-5-4-6-8-16/h4-8,13-14H,3,9-12H2,1-2H3,(H,36,37)(H,29,35,39)/p-1