N-(3-chloranyl-4-methyl-phenyl)-5-[(4-ethylphenyl)methyl-(furan-2-ylmethyl)amino]-2-methylsulfonyl-pyrimidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-5-[(4-ethylphenyl)methyl-(furan-2-ylmethyl)amino]-2-methylsulfonyl-pyrimidine-4-carboxamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-5-[(4-ethylphenyl)methyl-(2-furylmethyl)amino]-2-methylsulfonyl-pyrimidine-4-carboxamide CAS Name: N-(3-chloro-4-methylphenyl)-5-[(4-ethylphenyl)methyl-(2-furanylmethyl)amino]-2-methylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: N-(3-chloro-4-methylphenyl)-5-[(4-ethylphenyl)methyl-(furan-2-ylmethyl)amino]-2-methylsulfonylpyrimidine-4-carboxamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-5-[(4-ethylbenzyl)-(2-furfuryl)amino]-2-mesyl-pyrimidine-4-carboxamide Formula: C27H27ClN4O4S MolecularWeight: 539.04568

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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)Cl)S(=O)(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C27H27ClN4O4S/c1-4-19-8-10-20(11-9-19)16-32(17-22-6-5-13-36-22)24-15-29-27(37(3,34)35)31-25(24)26(33)30-21-12-7-18(2)23(28)14-21/h5-15H,4,16-17H2,1-3H3,(H,30,33)