N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(5-fluoranyl-2-methoxy-phenyl)sulfonylamino]-3-phenyl-propanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(5-fluoranyl-2-methoxy-phenyl)sulfonylamino]-3-phenyl-propanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(5-fluoro-2-methoxy-phenyl)sulfonylamino]-3-phenyl-propanamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(5-fluoro-2-methoxyphenyl)sulfonylamino]-3-phenylpropanamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(5-fluoro-2-methoxyphenyl)sulfonylamino]-3-phenylpropanamide Traditional Name: 2-[(5-fluoro-2-methoxy-phenyl)sulfonylamino]-N-homoveratryl-3-phenyl-propionamide Formula: C26H29FN2O6S MolecularWeight: 516.581663

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C(CC2=CC=CC=C2)NS(=O)(=O)C3=C(C=CC(=C3)F)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C(CC2=CC=CC=C2)NS(=O)(=O)C3=C(C=CC(=C3)F)OC)OC

InChI

InChI=1S/C26H29FN2O6S/c1-33-22-11-9-19(16-24(22)35-3)13-14-28-26(30)21(15-18-7-5-4-6-8-18)29-36(31,32)25-17-20(27)10-12-23(25)34-2/h4-12,16-17,21,29H,13-15H2,1-3H3,(H,28,30)