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

Systemtic Name: N-(4-ethylphenyl)-5-[furan-2-ylmethyl-(phenylmethyl)amino]-2-methylsulfonyl-pyrimidine-4-carboxamide Openeye Name: 5-[benzyl(2-furylmethyl)amino]-N-(4-ethylphenyl)-2-methylsulfonyl-pyrimidine-4-carboxamide CAS Name: N-(4-ethylphenyl)-5-[2-furanylmethyl-(phenylmethyl)amino]-2-methylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: 5-[benzyl(furan-2-ylmethyl)amino]-N-(4-ethylphenyl)-2-methylsulfonylpyrimidine-4-carboxamide Traditional Name: 5-[benzyl(2-furfuryl)amino]-N-(4-ethylphenyl)-2-mesyl-pyrimidine-4-carboxamide Formula: C26H26N4O4S MolecularWeight: 490.57404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H26N4O4S/c1-3-19-11-13-21(14-12-19)28-25(31)24-23(16-27-26(29-24)35(2,32)33)30(18-22-10-7-15-34-22)17-20-8-5-4-6-9-20/h4-16H,3,17-18H2,1-2H3,(H,28,31)