ethyl 2-[3-[(2-chlorophenyl)methyl]-4-oxidanylidene-pteridin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[3-[(2-chlorophenyl)methyl]-4-oxidanylidene-pteridin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[3-[(2-chlorophenyl)methyl]-4-oxo-pteridin-2-yl]sulfanylacetate CAS Name: 2-[[3-[(2-chlorophenyl)methyl]-4-oxo-2-pteridinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[(2-chlorophenyl)methyl]-4-oxopteridin-2-yl]sulfanylacetate Traditional Name: 2-[[3-(2-chlorobenzyl)-4-keto-pteridin-2-yl]thio]acetic acid ethyl ester Formula: C17H15ClN4O3S MolecularWeight: 390.844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=NC=CN=C2C(=O)N1CC3=CC=CC=C3Cl

Isomeric SMILES

CCOC(=O)CSC1=NC2=NC=CN=C2C(=O)N1CC3=CC=CC=C3Cl

InChI

InChI=1S/C17H15ClN4O3S/c1-2-25-13(23)10-26-17-21-15-14(19-7-8-20-15)16(24)22(17)9-11-5-3-4-6-12(11)18/h3-8H,2,9-10H2,1H3