3-[2-[(3,4-dichlorophenyl)methylamino]-7-oxidanylidene-6-pyridin-3-yl-pteridin-8-yl]propanamide

Systemtic Name: 3-[2-[(3,4-dichlorophenyl)methylamino]-7-oxidanylidene-6-pyridin-3-yl-pteridin-8-yl]propanamide Openeye Name: 3-[2-[(3,4-dichlorophenyl)methylamino]-7-oxo-6-(3-pyridyl)pteridin-8-yl]propanamide CAS Name: 3-[2-[(3,4-dichlorophenyl)methylamino]-7-oxo-6-(3-pyridinyl)-8-pteridinyl]propanamide IUPAC Name: 3-[2-[(3,4-dichlorophenyl)methylamino]-7-oxo-6-pyridin-3-ylpteridin-8-yl]propanamide Traditional Name: 3-[2-[(3,4-dichlorobenzyl)amino]-7-keto-6-(3-pyridyl)pteridin-8-yl]propionamide Formula: C21H17Cl2N7O2 MolecularWeight: 470.31138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NC3=CN=C(N=C3N(C2=O)CCC(=O)N)NCC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC(=CN=C1)C2=NC3=CN=C(N=C3N(C2=O)CCC(=O)N)NCC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H17Cl2N7O2/c22-14-4-3-12(8-15(14)23)9-26-21-27-11-16-19(29-21)30(7-5-17(24)31)20(32)18(28-16)13-2-1-6-25-10-13/h1-4,6,8,10-11H,5,7,9H2,(H2,24,31)(H,26,27,29)