2-[[3-[3-oxidanylidene-4-phenyl-2-(pyridin-3-ylmethyl)-2H-pyrido[2,3-b]pyrazin-1-yl]phenyl]carbamoyl]benzoic acid

Systemtic Name: 2-[[3-[3-oxidanylidene-4-phenyl-2-(pyridin-3-ylmethyl)-2H-pyrido[2,3-b]pyrazin-1-yl]phenyl]carbamoyl]benzoic acid Openeye Name: 2-[[3-[3-oxo-4-phenyl-2-(3-pyridylmethyl)-2H-pyrido[2,3-b]pyrazin-1-yl]phenyl]carbamoyl]benzoic acid CAS Name: 2-[oxo-[3-[3-oxo-4-phenyl-2-(3-pyridinylmethyl)-2H-pyrido[2,3-b]pyrazin-1-yl]anilino]methyl]benzoic acid IUPAC Name: 2-[[3-[3-oxo-4-phenyl-2-(pyridin-3-ylmethyl)-2H-pyrido[2,3-b]pyrazin-1-yl]phenyl]carbamoyl]benzoic acid Traditional Name: 2-[[3-[3-keto-4-phenyl-2-(3-pyridylmethyl)-2H-pyrido[2,3-b]pyrazin-1-yl]phenyl]carbamoyl]benzoic acid Formula: C33H25N5O4 MolecularWeight: 555.5827

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(N(C3=C2N=CC=C3)C4=CC(=CC=C4)NC(=O)C5=CC=CC=C5C(=O)O)CC6=CN=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(N(C3=C2N=CC=C3)C4=CC(=CC=C4)NC(=O)C5=CC=CC=C5C(=O)O)CC6=CN=CC=C6

InChI

InChI=1S/C33H25N5O4/c39-31(26-14-4-5-15-27(26)33(41)42)36-23-10-6-13-25(20-23)37-28-16-8-18-35-30(28)38(24-11-2-1-3-12-24)32(40)29(37)19-22-9-7-17-34-21-22/h1-18,20-21,29H,19H2,(H,36,39)(H,41,42)