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

Systemtic Name: 2-ethylsulfonyl-5-[furan-2-ylmethyl-[(2-propoxyphenyl)methyl]amino]-N-(2-methylphenyl)pyrimidine-4-carboxamide Openeye Name: 2-ethylsulfonyl-5-[2-furylmethyl-[(2-propoxyphenyl)methyl]amino]-N-(o-tolyl)pyrimidine-4-carboxamide CAS Name: 2-ethylsulfonyl-5-[2-furanylmethyl-[(2-propoxyphenyl)methyl]amino]-N-(2-methylphenyl)-4-pyrimidinecarboxamide IUPAC Name: 2-ethylsulfonyl-5-[furan-2-ylmethyl-[(2-propoxyphenyl)methyl]amino]-N-(2-methylphenyl)pyrimidine-4-carboxamide Traditional Name: 2-esyl-5-[2-furfuryl-(2-propoxybenzyl)amino]-N-(o-tolyl)pyrimidine-4-carboxamide Formula: C29H32N4O5S MolecularWeight: 548.65318

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1CN(CC2=CC=CO2)C3=CN=C(N=C3C(=O)NC4=CC=CC=C4C)S(=O)(=O)CC

Isomeric SMILES

CCCOC1=CC=CC=C1CN(CC2=CC=CO2)C3=CN=C(N=C3C(=O)NC4=CC=CC=C4C)S(=O)(=O)CC

InChI

InChI=1S/C29H32N4O5S/c1-4-16-38-26-15-9-7-12-22(26)19-33(20-23-13-10-17-37-23)25-18-30-29(39(35,36)5-2)32-27(25)28(34)31-24-14-8-6-11-21(24)3/h6-15,17-18H,4-5,16,19-20H2,1-3H3,(H,31,34)