methyl 5-[(3,4-dihydro-2H-thiochromen-4-ylamino)methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[(3,4-dihydro-2H-thiochromen-4-ylamino)methyl]furan-2-carboxylate Openeye Name: methyl 5-[(thiochroman-4-ylamino)methyl]furan-2-carboxylate CAS Name: 5-[(3,4-dihydro-2H-1-benzothiopyran-4-ylamino)methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(3,4-dihydro-2H-thiochromen-4-ylamino)methyl]furan-2-carboxylate Traditional Name: 5-[(thiochroman-4-ylamino)methyl]furan-2-carboxylic acid methyl ester Formula: C16H17NO3S MolecularWeight: 303.37608

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CNC2CCSC3=CC=CC=C23

Isomeric SMILES

COC(=O)C1=CC=C(O1)CNC2CCSC3=CC=CC=C23

InChI

InChI=1S/C16H17NO3S/c1-19-16(18)14-7-6-11(20-14)10-17-13-8-9-21-15-5-3-2-4-12(13)15/h2-7,13,17H,8-10H2,1H3