methyl 2-(7-oxidanylidene-8-phenyl-2-phenylazanyl-pteridin-6-yl)ethanoate

Systemtic Name: methyl 2-(7-oxidanylidene-8-phenyl-2-phenylazanyl-pteridin-6-yl)ethanoate Openeye Name: methyl 2-(2-anilino-7-oxo-8-phenyl-pteridin-6-yl)acetate CAS Name: 2-(2-anilino-7-oxo-8-phenyl-6-pteridinyl)acetic acid methyl ester IUPAC Name: methyl 2-(2-anilino-7-oxo-8-phenylpteridin-6-yl)acetate Traditional Name: 2-(2-anilino-7-keto-8-phenyl-pteridin-6-yl)acetic acid methyl ester Formula: C21H17N5O3 MolecularWeight: 387.39138

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=NC2=CN=C(N=C2N(C1=O)C3=CC=CC=C3)NC4=CC=CC=C4

Isomeric SMILES

COC(=O)CC1=NC2=CN=C(N=C2N(C1=O)C3=CC=CC=C3)NC4=CC=CC=C4

InChI

InChI=1S/C21H17N5O3/c1-29-18(27)12-16-20(28)26(15-10-6-3-7-11-15)19-17(24-16)13-22-21(25-19)23-14-8-4-2-5-9-14/h2-11,13H,12H2,1H3,(H,22,23,25)