2-[4-oxidanylidene-3-(phenylmethyl)pteridin-2-yl]sulfanylethanamide

Systemtic Name: 2-[4-oxidanylidene-3-(phenylmethyl)pteridin-2-yl]sulfanylethanamide Openeye Name: 2-(3-benzyl-4-oxo-pteridin-2-yl)sulfanylacetamide CAS Name: 2-[[4-oxo-3-(phenylmethyl)-2-pteridinyl]thio]acetamide IUPAC Name: 2-(3-benzyl-4-oxopteridin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-benzyl-4-keto-pteridin-2-yl)thio]acetamide Formula: C15H13N5O2S MolecularWeight: 327.36102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=NC=CN=C3N=C2SCC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=NC=CN=C3N=C2SCC(=O)N

InChI

InChI=1S/C15H13N5O2S/c16-11(21)9-23-15-19-13-12(17-6-7-18-13)14(22)20(15)8-10-4-2-1-3-5-10/h1-7H,8-9H2,(H2,16,21)