2-[3-[2-(1H-indol-3-yl)ethyl]-4-oxidanylidene-pteridin-2-yl]sulfanyl-N-(3-methylphenyl)ethanamide

Systemtic Name: 2-[3-[2-(1H-indol-3-yl)ethyl]-4-oxidanylidene-pteridin-2-yl]sulfanyl-N-(3-methylphenyl)ethanamide Openeye Name: 2-[3-[2-(1H-indol-3-yl)ethyl]-4-oxo-pteridin-2-yl]sulfanyl-N-(m-tolyl)acetamide CAS Name: 2-[[3-[2-(1H-indol-3-yl)ethyl]-4-oxo-2-pteridinyl]thio]-N-(3-methylphenyl)acetamide IUPAC Name: 2-[3-[2-(1H-indol-3-yl)ethyl]-4-oxopteridin-2-yl]sulfanyl-N-(3-methylphenyl)acetamide Traditional Name: 2-[[3-[2-(1H-indol-3-yl)ethyl]-4-keto-pteridin-2-yl]thio]-N-(m-tolyl)acetamide Formula: C25H22N6O2S MolecularWeight: 470.54618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSC2=NC3=NC=CN=C3C(=O)N2CCC4=CNC5=CC=CC=C54

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSC2=NC3=NC=CN=C3C(=O)N2CCC4=CNC5=CC=CC=C54

InChI

InChI=1S/C25H22N6O2S/c1-16-5-4-6-18(13-16)29-21(32)15-34-25-30-23-22(26-10-11-27-23)24(33)31(25)12-9-17-14-28-20-8-3-2-7-19(17)20/h2-8,10-11,13-14,28H,9,12,15H2,1H3,(H,29,32)