methyl (2S)-2-(3,4-dihydro-2H-thiochromen-4-ylamino)propanoate

Systemtic Name: methyl (2S)-2-(3,4-dihydro-2H-thiochromen-4-ylamino)propanoate Openeye Name: methyl (2S)-2-(thiochroman-4-ylamino)propanoate CAS Name: (2S)-2-(3,4-dihydro-2H-1-benzothiopyran-4-ylamino)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-(3,4-dihydro-2H-thiochromen-4-ylamino)propanoate Traditional Name: (2S)-2-(thiochroman-4-ylamino)propionic acid methyl ester Formula: C13H17NO2S MolecularWeight: 251.34458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NC1CCSC2=CC=CC=C12

Isomeric SMILES

C[C@@H](C(=O)OC)NC1CCSC2=CC=CC=C12

InChI

InChI=1S/C13H17NO2S/c1-9(13(15)16-2)14-11-7-8-17-12-6-4-3-5-10(11)12/h3-6,9,11,14H,7-8H2,1-2H3/t9-,11?/m0/s1