N-(2,5-dimethylphenyl)-2-ethylsulfonyl-5-[furan-2-ylmethyl-[(4-methylphenyl)methyl]amino]pyrimidine-4-carboxamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-ethylsulfonyl-5-[furan-2-ylmethyl-[(4-methylphenyl)methyl]amino]pyrimidine-4-carboxamide Openeye Name: N-(2,5-dimethylphenyl)-2-ethylsulfonyl-5-[2-furylmethyl(p-tolylmethyl)amino]pyrimidine-4-carboxamide CAS Name: N-(2,5-dimethylphenyl)-2-ethylsulfonyl-5-[2-furanylmethyl-[(4-methylphenyl)methyl]amino]-4-pyrimidinecarboxamide IUPAC Name: N-(2,5-dimethylphenyl)-2-ethylsulfonyl-5-[furan-2-ylmethyl-[(4-methylphenyl)methyl]amino]pyrimidine-4-carboxamide Traditional Name: N-(2,5-dimethylphenyl)-2-esyl-5-[2-furfuryl-(4-methylbenzyl)amino]pyrimidine-4-carboxamide Formula: C28H30N4O4S MolecularWeight: 518.6272

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=C(C=CC(=C2)C)C)N(CC3=CC=C(C=C3)C)CC4=CC=CO4

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=C(C=CC(=C2)C)C)N(CC3=CC=C(C=C3)C)CC4=CC=CO4

InChI

InChI=1S/C28H30N4O4S/c1-5-37(34,35)28-29-16-25(26(31-28)27(33)30-24-15-20(3)8-11-21(24)4)32(18-23-7-6-14-36-23)17-22-12-9-19(2)10-13-22/h6-16H,5,17-18H2,1-4H3,(H,30,33)