3-azanyl-N-[5-(3-azanylpiperidin-1-yl)-2-oxidanylidene-1H-pyrimidin-6-yl]-6-(2-chlorophenyl)pyrazine-2-carboxamide

Systemtic Name: 3-azanyl-N-[5-(3-azanylpiperidin-1-yl)-2-oxidanylidene-1H-pyrimidin-6-yl]-6-(2-chlorophenyl)pyrazine-2-carboxamide Openeye Name: 3-amino-N-[5-(3-amino-1-piperidyl)-2-oxo-1H-pyrimidin-6-yl]-6-(2-chlorophenyl)pyrazine-2-carboxamide CAS Name: 3-amino-N-[5-(3-amino-1-piperidinyl)-2-oxo-1H-pyrimidin-6-yl]-6-(2-chlorophenyl)-2-pyrazinecarboxamide IUPAC Name: 3-amino-N-[5-(3-aminopiperidin-1-yl)-2-oxo-1H-pyrimidin-6-yl]-6-(2-chlorophenyl)pyrazine-2-carboxamide Traditional Name: 3-amino-N-[5-(3-aminopiperidino)-2-keto-1H-pyrimidin-6-yl]-6-(2-chlorophenyl)pyrazinamide Formula: C20H21ClN8O2 MolecularWeight: 440.88614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=C(NC(=O)N=C2)NC(=O)C3=NC(=CN=C3N)C4=CC=CC=C4Cl)N

Isomeric SMILES

C1CC(CN(C1)C2=C(NC(=O)N=C2)NC(=O)C3=NC(=CN=C3N)C4=CC=CC=C4Cl)N

InChI

InChI=1S/C20H21ClN8O2/c21-13-6-2-1-5-12(13)14-8-24-17(23)16(26-14)19(30)27-18-15(9-25-20(31)28-18)29-7-3-4-11(22)10-29/h1-2,5-6,8-9,11H,3-4,7,10,22H2,(H2,23,24)(H2,25,27,28,30,31)