5-[(3,4-dimethoxyphenyl)methyl-(furan-2-ylmethyl)amino]-N-(2,4-dimethylphenyl)-2-methylsulfonyl-pyrimidine-4-carboxamide

Systemtic Name: 5-[(3,4-dimethoxyphenyl)methyl-(furan-2-ylmethyl)amino]-N-(2,4-dimethylphenyl)-2-methylsulfonyl-pyrimidine-4-carboxamide Openeye Name: 5-[(3,4-dimethoxyphenyl)methyl-(2-furylmethyl)amino]-N-(2,4-dimethylphenyl)-2-methylsulfonyl-pyrimidine-4-carboxamide CAS Name: 5-[(3,4-dimethoxyphenyl)methyl-(2-furanylmethyl)amino]-N-(2,4-dimethylphenyl)-2-methylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: 5-[(3,4-dimethoxyphenyl)methyl-(furan-2-ylmethyl)amino]-N-(2,4-dimethylphenyl)-2-methylsulfonylpyrimidine-4-carboxamide Traditional Name: N-(2,4-dimethylphenyl)-5-[2-furfuryl(veratryl)amino]-2-mesyl-pyrimidine-4-carboxamide Formula: C28H30N4O6S MolecularWeight: 550.626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=NC(=NC=C2N(CC3=CC(=C(C=C3)OC)OC)CC4=CC=CO4)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=NC(=NC=C2N(CC3=CC(=C(C=C3)OC)OC)CC4=CC=CO4)S(=O)(=O)C)C

InChI

InChI=1S/C28H30N4O6S/c1-18-8-10-22(19(2)13-18)30-27(33)26-23(15-29-28(31-26)39(5,34)35)32(17-21-7-6-12-38-21)16-20-9-11-24(36-3)25(14-20)37-4/h6-15H,16-17H2,1-5H3,(H,30,33)