3-(3,4-dihydro-2H-thiochromen-4-ylamino)-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: 3-(3,4-dihydro-2H-thiochromen-4-ylamino)-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 1-pyrrolidin-1-yl-3-(thiochroman-4-ylamino)propan-1-one CAS Name: 3-(3,4-dihydro-2H-1-benzothiopyran-4-ylamino)-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 3-(3,4-dihydro-2H-thiochromen-4-ylamino)-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 1-pyrrolidino-3-(thiochroman-4-ylamino)propan-1-one Formula: C16H22N2OS MolecularWeight: 290.42368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CCNC2CCSC3=CC=CC=C23

Isomeric SMILES

C1CCN(C1)C(=O)CCNC2CCSC3=CC=CC=C23

InChI

InChI=1S/C16H22N2OS/c19-16(18-10-3-4-11-18)7-9-17-14-8-12-20-15-6-2-1-5-13(14)15/h1-2,5-6,14,17H,3-4,7-12H2