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

Systemtic Name: 5-[(4-tert-butylphenyl)methyl-(furan-2-ylmethyl)amino]-2-methylsulfonyl-N-phenyl-pyrimidine-4-carboxamide Openeye Name: 5-[(4-tert-butylphenyl)methyl-(2-furylmethyl)amino]-2-methylsulfonyl-N-phenyl-pyrimidine-4-carboxamide CAS Name: 5-[(4-tert-butylphenyl)methyl-(2-furanylmethyl)amino]-2-methylsulfonyl-N-phenyl-4-pyrimidinecarboxamide IUPAC Name: 5-[(4-tert-butylphenyl)methyl-(furan-2-ylmethyl)amino]-2-methylsulfonyl-N-phenylpyrimidine-4-carboxamide Traditional Name: 5-[(4-tert-butylbenzyl)-(2-furfuryl)amino]-2-mesyl-N-phenyl-pyrimidine-4-carboxamide Formula: C28H30N4O4S MolecularWeight: 518.6272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN(CC2=CC=CO2)C3=CN=C(N=C3C(=O)NC4=CC=CC=C4)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN(CC2=CC=CO2)C3=CN=C(N=C3C(=O)NC4=CC=CC=C4)S(=O)(=O)C

InChI

InChI=1S/C28H30N4O4S/c1-28(2,3)21-14-12-20(13-15-21)18-32(19-23-11-8-16-36-23)24-17-29-27(37(4,34)35)31-25(24)26(33)30-22-9-6-5-7-10-22/h5-17H,18-19H2,1-4H3,(H,30,33)