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

Systemtic Name: N-(4-ethylphenyl)-5-[furan-2-ylmethyl-[(4-methylphenyl)methyl]amino]-2-methylsulfonyl-pyrimidine-4-carboxamide Openeye Name: N-(4-ethylphenyl)-5-[2-furylmethyl(p-tolylmethyl)amino]-2-methylsulfonyl-pyrimidine-4-carboxamide CAS Name: N-(4-ethylphenyl)-5-[2-furanylmethyl-[(4-methylphenyl)methyl]amino]-2-methylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: N-(4-ethylphenyl)-5-[furan-2-ylmethyl-[(4-methylphenyl)methyl]amino]-2-methylsulfonylpyrimidine-4-carboxamide Traditional Name: N-(4-ethylphenyl)-5-[2-furfuryl-(4-methylbenzyl)amino]-2-mesyl-pyrimidine-4-carboxamide Formula: C27H28N4O4S MolecularWeight: 504.60062

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=NC(=NC=C2N(CC3=CC=C(C=C3)C)CC4=CC=CO4)S(=O)(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=NC(=NC=C2N(CC3=CC=C(C=C3)C)CC4=CC=CO4)S(=O)(=O)C

InChI

InChI=1S/C27H28N4O4S/c1-4-20-11-13-22(14-12-20)29-26(32)25-24(16-28-27(30-25)36(3,33)34)31(18-23-6-5-15-35-23)17-21-9-7-19(2)8-10-21/h5-16H,4,17-18H2,1-3H3,(H,29,32)