N-(3,4-dimethylphenyl)-5-[(4-ethylphenyl)methyl-(furan-2-ylmethyl)amino]-2-ethylsulfonyl-pyrimidine-4-carboxamide

Systemtic Name: N-(3,4-dimethylphenyl)-5-[(4-ethylphenyl)methyl-(furan-2-ylmethyl)amino]-2-ethylsulfonyl-pyrimidine-4-carboxamide Openeye Name: N-(3,4-dimethylphenyl)-5-[(4-ethylphenyl)methyl-(2-furylmethyl)amino]-2-ethylsulfonyl-pyrimidine-4-carboxamide CAS Name: N-(3,4-dimethylphenyl)-5-[(4-ethylphenyl)methyl-(2-furanylmethyl)amino]-2-ethylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: N-(3,4-dimethylphenyl)-5-[(4-ethylphenyl)methyl-(furan-2-ylmethyl)amino]-2-ethylsulfonylpyrimidine-4-carboxamide Traditional Name: N-(3,4-dimethylphenyl)-2-esyl-5-[(4-ethylbenzyl)-(2-furfuryl)amino]pyrimidine-4-carboxamide Formula: C29H32N4O4S MolecularWeight: 532.65378

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(CC2=CC=CO2)C3=CN=C(N=C3C(=O)NC4=CC(=C(C=C4)C)C)S(=O)(=O)CC

Isomeric SMILES

CCC1=CC=C(C=C1)CN(CC2=CC=CO2)C3=CN=C(N=C3C(=O)NC4=CC(=C(C=C4)C)C)S(=O)(=O)CC

InChI

InChI=1S/C29H32N4O4S/c1-5-22-10-12-23(13-11-22)18-33(19-25-8-7-15-37-25)26-17-30-29(38(35,36)6-2)32-27(26)28(34)31-24-14-9-20(3)21(4)16-24/h7-17H,5-6,18-19H2,1-4H3,(H,31,34)