N-[4-[(8-cyclopentyl-7-oxidanylidene-pteridin-2-yl)amino]phenyl]propanamide

Systemtic Name: N-[4-[(8-cyclopentyl-7-oxidanylidene-pteridin-2-yl)amino]phenyl]propanamide Openeye Name: N-[4-[(8-cyclopentyl-7-oxo-pteridin-2-yl)amino]phenyl]propanamide CAS Name: N-[4-[(8-cyclopentyl-7-oxo-2-pteridinyl)amino]phenyl]propanamide IUPAC Name: N-[4-[(8-cyclopentyl-7-oxopteridin-2-yl)amino]phenyl]propanamide Traditional Name: N-[4-[(8-cyclopentyl-7-keto-pteridin-2-yl)amino]phenyl]propionamide Formula: C20H22N6O2 MolecularWeight: 378.42768

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)NC2=NC=C3C(=N2)N(C(=O)C=N3)C4CCCC4

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)NC2=NC=C3C(=N2)N(C(=O)C=N3)C4CCCC4

InChI

InChI=1S/C20H22N6O2/c1-2-17(27)23-13-7-9-14(10-8-13)24-20-22-11-16-19(25-20)26(18(28)12-21-16)15-5-3-4-6-15/h7-12,15H,2-6H2,1H3,(H,23,27)(H,22,24,25)