N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-4-(2-oxidanylidenepyrrolidin-1-yl)benzamide

Systemtic Name: N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-4-(2-oxidanylidenepyrrolidin-1-yl)benzamide Openeye Name: 4-(2-oxopyrrolidin-1-yl)-N-[(4S)-thiochroman-4-yl]benzamide CAS Name: N-[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]-4-(2-oxo-1-pyrrolidinyl)benzamide IUPAC Name: N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-4-(2-oxopyrrolidin-1-yl)benzamide Traditional Name: 4-(2-ketopyrrolidino)-N-[(4S)-thiochroman-4-yl]benzamide Formula: C20H20N2O2S MolecularWeight: 352.45

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)NC3CCSC4=CC=CC=C34

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)N[C@H]3CCSC4=CC=CC=C34

InChI

InChI=1S/C20H20N2O2S/c23-19-6-3-12-22(19)15-9-7-14(8-10-15)20(24)21-17-11-13-25-18-5-2-1-4-16(17)18/h1-2,4-5,7-10,17H,3,6,11-13H2,(H,21,24)/t17-/m0/s1