N-[2-[2-[(3,4-dichlorophenyl)methylamino]-7-oxidanylidene-6-pyrimidin-2-yl-pteridin-8-yl]ethyl]ethanamide

Systemtic Name: N-[2-[2-[(3,4-dichlorophenyl)methylamino]-7-oxidanylidene-6-pyrimidin-2-yl-pteridin-8-yl]ethyl]ethanamide Openeye Name: N-[2-[2-[(3,4-dichlorophenyl)methylamino]-7-oxo-6-pyrimidin-2-yl-pteridin-8-yl]ethyl]acetamide CAS Name: N-[2-[2-[(3,4-dichlorophenyl)methylamino]-7-oxo-6-(2-pyrimidinyl)-8-pteridinyl]ethyl]acetamide IUPAC Name: N-[2-[2-[(3,4-dichlorophenyl)methylamino]-7-oxo-6-pyrimidin-2-ylpteridin-8-yl]ethyl]acetamide Traditional Name: N-[2-[2-[(3,4-dichlorobenzyl)amino]-7-keto-6-(2-pyrimidyl)pteridin-8-yl]ethyl]acetamide Formula: C21H18Cl2N8O2 MolecularWeight: 485.32602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCN1C2=NC(=NC=C2N=C(C1=O)C3=NC=CC=N3)NCC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CC(=O)NCCN1C2=NC(=NC=C2N=C(C1=O)C3=NC=CC=N3)NCC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H18Cl2N8O2/c1-12(32)24-7-8-31-19-16(29-17(20(31)33)18-25-5-2-6-26-18)11-28-21(30-19)27-10-13-3-4-14(22)15(23)9-13/h2-6,9,11H,7-8,10H2,1H3,(H,24,32)(H,27,28,30)