N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-5-methylsulfonyl-thiophene-2-carboxamide

Systemtic Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-5-methylsulfonyl-thiophene-2-carboxamide Openeye Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-5-methylsulfonyl-thiophene-2-carboxamide CAS Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-4-pyrimidinyl]amino]ethyl]-5-methylsulfonyl-2-thiophenecarboxamide IUPAC Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenylpyrimidin-4-yl]amino]ethyl]-5-methylsulfonylthiophene-2-carboxamide Traditional Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-5-mesyl-thiophene-2-carboxamide Formula: C23H28N6O4S2 MolecularWeight: 516.63622

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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=CC=C(S3)S(=O)(=O)C

Isomeric SMILES

CC1=C(N=C(N=C1NCCNC(=O)C)C2=CC=CC=C2)NCCNC(=O)C3=CC=C(S3)S(=O)(=O)C

InChI

InChI=1S/C23H28N6O4S2/c1-15-20(25-12-11-24-16(2)30)28-22(17-7-5-4-6-8-17)29-21(15)26-13-14-27-23(31)18-9-10-19(34-18)35(3,32)33/h4-10H,11-14H2,1-3H3,(H,24,30)(H,27,31)(H2,25,26,28,29)