methyl (2R)-2-[[(4R)-3,4-dihydro-2H-thiochromen-4-yl]amino]-2-phenyl-ethanoate

Systemtic Name: methyl (2R)-2-[[(4R)-3,4-dihydro-2H-thiochromen-4-yl]amino]-2-phenyl-ethanoate Openeye Name: methyl (2R)-2-phenyl-2-[[(4R)-thiochroman-4-yl]amino]acetate CAS Name: (2R)-2-[[(4R)-3,4-dihydro-2H-1-benzothiopyran-4-yl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl (2R)-2-[[(4R)-3,4-dihydro-2H-thiochromen-4-yl]amino]-2-phenylacetate Traditional Name: (2R)-2-phenyl-2-[[(4R)-thiochroman-4-yl]amino]acetic acid methyl ester Formula: C18H19NO2S MolecularWeight: 313.41396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)NC2CCSC3=CC=CC=C23

Isomeric SMILES

COC(=O)[C@@H](C1=CC=CC=C1)N[C@@H]2CCSC3=CC=CC=C23

InChI

InChI=1S/C18H19NO2S/c1-21-18(20)17(13-7-3-2-4-8-13)19-15-11-12-22-16-10-6-5-9-14(15)16/h2-10,15,17,19H,11-12H2,1H3/t15-,17-/m1/s1