(2S)-2-[[(4R)-8-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]amino]-2-phenyl-1-pyrrolidin-1-yl-ethanone

Systemtic Name: (2S)-2-[[(4R)-8-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]amino]-2-phenyl-1-pyrrolidin-1-yl-ethanone Openeye Name: (2S)-2-[[(4R)-8-fluorothiochroman-4-yl]amino]-2-phenyl-1-pyrrolidin-1-yl-ethanone CAS Name: (2S)-2-[[(4R)-8-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl]amino]-2-phenyl-1-(1-pyrrolidinyl)ethanone IUPAC Name: (2S)-2-[[(4R)-8-fluoro-3,4-dihydro-2H-thiochromen-4-yl]amino]-2-phenyl-1-pyrrolidin-1-ylethanone Traditional Name: (2S)-2-[[(4R)-8-fluorothiochroman-4-yl]amino]-2-phenyl-1-pyrrolidino-ethanone Formula: C21H23FN2OS MolecularWeight: 370.483523

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C(C2=CC=CC=C2)NC3CCSC4=C3C=CC=C4F

Isomeric SMILES

C1CCN(C1)C(=O)[C@H](C2=CC=CC=C2)N[C@@H]3CCSC4=C3C=CC=C4F

InChI

InChI=1S/C21H23FN2OS/c22-17-10-6-9-16-18(11-14-26-20(16)17)23-19(15-7-2-1-3-8-15)21(25)24-12-4-5-13-24/h1-3,6-10,18-19,23H,4-5,11-14H2/t18-,19+/m1/s1