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

Systemtic Name: 2-[3-[(2-chlorophenyl)methyl]-4-oxidanylidene-pteridin-2-yl]sulfanylethanenitrile Openeye Name: 2-[3-[(2-chlorophenyl)methyl]-4-oxo-pteridin-2-yl]sulfanylacetonitrile CAS Name: 2-[[3-[(2-chlorophenyl)methyl]-4-oxo-2-pteridinyl]thio]acetonitrile IUPAC Name: 2-[3-[(2-chlorophenyl)methyl]-4-oxopteridin-2-yl]sulfanylacetonitrile Traditional Name: 2-[[3-(2-chlorobenzyl)-4-keto-pteridin-2-yl]thio]acetonitrile Formula: C15H10ClN5OS MolecularWeight: 343.7908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H10ClN5OS/c16-11-4-2-1-3-10(11)9-21-14(22)12-13(19-7-6-18-12)20-15(21)23-8-5-17/h1-4,6-7H,8-9H2