N-[(1R,2S)-2-[5-fluoranyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]cyclopropyl]-N-methoxy-ethanamide

Systemtic Name: N-[(1R,2S)-2-[5-fluoranyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]cyclopropyl]-N-methoxy-ethanamide Openeye Name: N-[(1R,2S)-2-[5-fluoro-1-(p-tolylsulfonyl)indol-3-yl]cyclopropyl]-N-methoxy-acetamide CAS Name: N-[(1R,2S)-2-[5-fluoro-1-(4-methylphenyl)sulfonyl-3-indolyl]cyclopropyl]-N-methoxyacetamide IUPAC Name: N-[(1R,2S)-2-[5-fluoro-1-(4-methylphenyl)sulfonylindol-3-yl]cyclopropyl]-N-methoxyacetamide Traditional Name: N-[(1R,2S)-2-(5-fluoro-1-tosyl-indol-3-yl)cyclopropyl]-N-methoxy-acetamide Formula: C21H21FN2O4S MolecularWeight: 416.465843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)F)C4CC4N(C(=O)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)F)[C@@H]4C[C@H]4N(C(=O)C)OC

InChI

InChI=1S/C21H21FN2O4S/c1-13-4-7-16(8-5-13)29(26,27)23-12-19(17-10-15(22)6-9-20(17)23)18-11-21(18)24(28-3)14(2)25/h4-10,12,18,21H,11H2,1-3H3/t18-,21+/m0/s1