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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H30N4O4S/c1-4-16-37(34,35)28-29-17-25(26(31-28)27(33)30-23-13-9-21(3)10-14-23)32(19-24-6-5-15-36-24)18-22-11-7-20(2)8-12-22/h5-15,17H,4,16,18-19H2,1-3H3,(H,30,33)