N-(2-methoxy-5-pentan-3-ylsulfonyl-phenyl)-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-(2-methoxy-5-pentan-3-ylsulfonyl-phenyl)-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[5-(1-ethylpropylsulfonyl)-2-methoxy-phenyl]-2-phenyl-quinoline-4-carboxamide CAS Name: N-(2-methoxy-5-pentan-3-ylsulfonylphenyl)-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-(2-methoxy-5-pentan-3-ylsulfonylphenyl)-2-phenylquinoline-4-carboxamide Traditional Name: N-[5-(1-ethylpropylsulfonyl)-2-methoxy-phenyl]-2-phenyl-cinchoninamide Formula: C28H28N2O4S MolecularWeight: 488.59792

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CCC(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C28H28N2O4S/c1-4-20(5-2)35(32,33)21-15-16-27(34-3)26(17-21)30-28(31)23-18-25(19-11-7-6-8-12-19)29-24-14-10-9-13-22(23)24/h6-18,20H,4-5H2,1-3H3,(H,30,31)