(3R)-3-acetamido-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-3-phenyl-propanamide

Systemtic Name: (3R)-3-acetamido-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-3-phenyl-propanamide Openeye Name: (3R)-3-acetamido-3-phenyl-N-[(4S)-thiochroman-4-yl]propanamide CAS Name: (3R)-3-acetamido-N-[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]-3-phenylpropanamide IUPAC Name: (3R)-3-acetamido-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-3-phenylpropanamide Traditional Name: (3R)-3-acetamido-3-phenyl-N-[(4S)-thiochroman-4-yl]propionamide Formula: C20H22N2O2S MolecularWeight: 354.46588

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)NC1CCSC2=CC=CC=C12)C3=CC=CC=C3

Isomeric SMILES

CC(=O)N[C@H](CC(=O)N[C@H]1CCSC2=CC=CC=C12)C3=CC=CC=C3

InChI

InChI=1S/C20H22N2O2S/c1-14(23)21-18(15-7-3-2-4-8-15)13-20(24)22-17-11-12-25-19-10-6-5-9-16(17)19/h2-10,17-18H,11-13H2,1H3,(H,21,23)(H,22,24)/t17-,18+/m0/s1