N-(4-fluorophenyl)-5-[furan-2-ylmethyl-[(4-propan-2-ylphenyl)methyl]amino]-2-methylsulfonyl-pyrimidine-4-carboxamide

Systemtic Name: N-(4-fluorophenyl)-5-[furan-2-ylmethyl-[(4-propan-2-ylphenyl)methyl]amino]-2-methylsulfonyl-pyrimidine-4-carboxamide Openeye Name: N-(4-fluorophenyl)-5-[2-furylmethyl-[(4-isopropylphenyl)methyl]amino]-2-methylsulfonyl-pyrimidine-4-carboxamide CAS Name: N-(4-fluorophenyl)-5-[2-furanylmethyl-[(4-propan-2-ylphenyl)methyl]amino]-2-methylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: N-(4-fluorophenyl)-5-[furan-2-ylmethyl-[(4-propan-2-ylphenyl)methyl]amino]-2-methylsulfonylpyrimidine-4-carboxamide Traditional Name: N-(4-fluorophenyl)-5-[2-furfuryl-(4-isopropylbenzyl)amino]-2-mesyl-pyrimidine-4-carboxamide Formula: C27H27FN4O4S MolecularWeight: 522.591083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H27FN4O4S/c1-18(2)20-8-6-19(7-9-20)16-32(17-23-5-4-14-36-23)24-15-29-27(37(3,34)35)31-25(24)26(33)30-22-12-10-21(28)11-13-22/h4-15,18H,16-17H2,1-3H3,(H,30,33)