2-acetamido-N-(3,4-dihydro-2H-thiochromen-4-yl)-3-(1H-indol-3-yl)propanamide

Systemtic Name: 2-acetamido-N-(3,4-dihydro-2H-thiochromen-4-yl)-3-(1H-indol-3-yl)propanamide Openeye Name: 2-acetamido-3-(1H-indol-3-yl)-N-thiochroman-4-yl-propanamide CAS Name: 2-acetamido-N-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-3-(1H-indol-3-yl)propanamide IUPAC Name: 2-acetamido-N-(3,4-dihydro-2H-thiochromen-4-yl)-3-(1H-indol-3-yl)propanamide Traditional Name: 2-acetamido-3-(1H-indol-3-yl)-N-thiochroman-4-yl-propionamide Formula: C22H23N3O2S MolecularWeight: 393.50192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC3CCSC4=CC=CC=C34

Isomeric SMILES

CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC3CCSC4=CC=CC=C34

InChI

InChI=1S/C22H23N3O2S/c1-14(26)24-20(12-15-13-23-18-8-4-2-6-16(15)18)22(27)25-19-10-11-28-21-9-5-3-7-17(19)21/h2-9,13,19-20,23H,10-12H2,1H3,(H,24,26)(H,25,27)