2-[3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-pteridin-2-yl]sulfanyl-N-(5-methyl-1H-pyrazol-3-yl)ethanamide

Systemtic Name: 2-[3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-pteridin-2-yl]sulfanyl-N-(5-methyl-1H-pyrazol-3-yl)ethanamide Openeye Name: 2-[3-[(4-methoxyphenyl)methyl]-4-oxo-pteridin-2-yl]sulfanyl-N-(5-methyl-1H-pyrazol-3-yl)acetamide CAS Name: 2-[[3-[(4-methoxyphenyl)methyl]-4-oxo-2-pteridinyl]thio]-N-(5-methyl-1H-pyrazol-3-yl)acetamide IUPAC Name: 2-[3-[(4-methoxyphenyl)methyl]-4-oxopteridin-2-yl]sulfanyl-N-(5-methyl-1H-pyrazol-3-yl)acetamide Traditional Name: 2-[(4-keto-3-p-anisyl-pteridin-2-yl)thio]-N-(5-methyl-1H-pyrazol-3-yl)acetamide Formula: C20H19N7O3S MolecularWeight: 437.47496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)NC(=O)CSC2=NC3=NC=CN=C3C(=O)N2CC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC(=NN1)NC(=O)CSC2=NC3=NC=CN=C3C(=O)N2CC4=CC=C(C=C4)OC

InChI

InChI=1S/C20H19N7O3S/c1-12-9-15(26-25-12)23-16(28)11-31-20-24-18-17(21-7-8-22-18)19(29)27(20)10-13-3-5-14(30-2)6-4-13/h3-9H,10-11H2,1-2H3,(H2,23,25,26,28)