2-[(4-fluorophenyl)sulfonylamino]ethyl 3-[2-methyl-3-(pyridin-3-ylmethyl)indol-1-yl]propanoate

Systemtic Name: 2-[(4-fluorophenyl)sulfonylamino]ethyl 3-[2-methyl-3-(pyridin-3-ylmethyl)indol-1-yl]propanoate Openeye Name: 2-[(4-fluorophenyl)sulfonylamino]ethyl 3-[2-methyl-3-(3-pyridylmethyl)indol-1-yl]propanoate CAS Name: 3-[2-methyl-3-(3-pyridinylmethyl)-1-indolyl]propanoic acid 2-[(4-fluorophenyl)sulfonylamino]ethyl ester IUPAC Name: 2-[(4-fluorophenyl)sulfonylamino]ethyl 3-[2-methyl-3-(pyridin-3-ylmethyl)indol-1-yl]propanoate Traditional Name: 3-[2-methyl-3-(3-pyridylmethyl)indol-1-yl]propionic acid 2-[(4-fluorophenyl)sulfonylamino]ethyl ester Formula: C26H26FN3O4S MolecularWeight: 495.565743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1CCC(=O)OCCNS(=O)(=O)C3=CC=C(C=C3)F)CC4=CN=CC=C4

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1CCC(=O)OCCNS(=O)(=O)C3=CC=C(C=C3)F)CC4=CN=CC=C4

InChI

InChI=1S/C26H26FN3O4S/c1-19-24(17-20-5-4-13-28-18-20)23-6-2-3-7-25(23)30(19)15-12-26(31)34-16-14-29-35(32,33)22-10-8-21(27)9-11-22/h2-11,13,18,29H,12,14-17H2,1H3