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

Systemtic Name: 5-[(4-tert-butylphenyl)methyl-(furan-2-ylmethyl)amino]-N-(2-methylphenyl)-2-methylsulfonyl-pyrimidine-4-carboxamide Openeye Name: 5-[(4-tert-butylphenyl)methyl-(2-furylmethyl)amino]-2-methylsulfonyl-N-(o-tolyl)pyrimidine-4-carboxamide CAS Name: 5-[(4-tert-butylphenyl)methyl-(2-furanylmethyl)amino]-N-(2-methylphenyl)-2-methylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: 5-[(4-tert-butylphenyl)methyl-(furan-2-ylmethyl)amino]-N-(2-methylphenyl)-2-methylsulfonylpyrimidine-4-carboxamide Traditional Name: 5-[(4-tert-butylbenzyl)-(2-furfuryl)amino]-2-mesyl-N-(o-tolyl)pyrimidine-4-carboxamide Formula: C29H32N4O4S MolecularWeight: 532.65378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=NC(=NC=C2N(CC3=CC=C(C=C3)C(C)(C)C)CC4=CC=CO4)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=NC(=NC=C2N(CC3=CC=C(C=C3)C(C)(C)C)CC4=CC=CO4)S(=O)(=O)C

InChI

InChI=1S/C29H32N4O4S/c1-20-9-6-7-11-24(20)31-27(34)26-25(17-30-28(32-26)38(5,35)36)33(19-23-10-8-16-37-23)18-21-12-14-22(15-13-21)29(2,3)4/h6-17H,18-19H2,1-5H3,(H,31,34)