N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-5-methyl-2-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-5-methyl-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-5-methyl-2-phenyl-triazole-4-carboxamide CAS Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-4-pyrimidinyl]amino]ethyl]-5-methyl-2-phenyl-4-triazolecarboxamide IUPAC Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenylpyrimidin-4-yl]amino]ethyl]-5-methyl-2-phenyltriazole-4-carboxamide Traditional Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-5-methyl-2-phenyl-triazole-4-carboxamide Formula: C27H31N9O2 MolecularWeight: 513.59414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1NCCNC(=O)C)C2=CC=CC=C2)NCCNC(=O)C3=NN(N=C3C)C4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(N=C1NCCNC(=O)C)C2=CC=CC=C2)NCCNC(=O)C3=NN(N=C3C)C4=CC=CC=C4

InChI

InChI=1S/C27H31N9O2/c1-18-24(29-15-14-28-20(3)37)32-26(21-10-6-4-7-11-21)33-25(18)30-16-17-31-27(38)23-19(2)34-36(35-23)22-12-8-5-9-13-22/h4-13H,14-17H2,1-3H3,(H,28,37)(H,31,38)(H2,29,30,32,33)