2-ethylsulfonyl-5-[furan-2-ylmethyl-[(4-methylphenyl)methyl]amino]-N-(3-methylphenyl)pyrimidine-4-carboxamide

Systemtic Name: 2-ethylsulfonyl-5-[furan-2-ylmethyl-[(4-methylphenyl)methyl]amino]-N-(3-methylphenyl)pyrimidine-4-carboxamide Openeye Name: 2-ethylsulfonyl-5-[2-furylmethyl(p-tolylmethyl)amino]-N-(m-tolyl)pyrimidine-4-carboxamide CAS Name: 2-ethylsulfonyl-5-[2-furanylmethyl-[(4-methylphenyl)methyl]amino]-N-(3-methylphenyl)-4-pyrimidinecarboxamide IUPAC Name: 2-ethylsulfonyl-5-[furan-2-ylmethyl-[(4-methylphenyl)methyl]amino]-N-(3-methylphenyl)pyrimidine-4-carboxamide Traditional Name: 2-esyl-5-[2-furfuryl-(4-methylbenzyl)amino]-N-(m-tolyl)pyrimidine-4-carboxamide Formula: C27H28N4O4S MolecularWeight: 504.60062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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