N-[2-[[6-(2-acetamidoethylamino)-2-(4-chlorophenyl)pyrimidin-4-yl]amino]ethyl]pyrazine-2-carboxamide

Systemtic Name: N-[2-[[6-(2-acetamidoethylamino)-2-(4-chlorophenyl)pyrimidin-4-yl]amino]ethyl]pyrazine-2-carboxamide Openeye Name: N-[2-[[6-(2-acetamidoethylamino)-2-(4-chlorophenyl)pyrimidin-4-yl]amino]ethyl]pyrazine-2-carboxamide CAS Name: N-[2-[[6-(2-acetamidoethylamino)-2-(4-chlorophenyl)-4-pyrimidinyl]amino]ethyl]-2-pyrazinecarboxamide IUPAC Name: N-[2-[[6-(2-acetamidoethylamino)-2-(4-chlorophenyl)pyrimidin-4-yl]amino]ethyl]pyrazine-2-carboxamide Traditional Name: N-[2-[[6-(2-acetamidoethylamino)-2-(4-chlorophenyl)pyrimidin-4-yl]amino]ethyl]pyrazinamide Formula: C21H23ClN8O2 MolecularWeight: 454.91272

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=NC(=NC(=C1)NCCNC(=O)C2=NC=CN=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(=O)NCCNC1=NC(=NC(=C1)NCCNC(=O)C2=NC=CN=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H23ClN8O2/c1-14(31)24-8-9-26-18-12-19(30-20(29-18)15-2-4-16(22)5-3-15)27-10-11-28-21(32)17-13-23-6-7-25-17/h2-7,12-13H,8-11H2,1H3,(H,24,31)(H,28,32)(H2,26,27,29,30)