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

Systemtic Name: (2R)-2-(4-chloranylphenoxy)-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]propanamide Openeye Name: (2R)-2-(4-chlorophenoxy)-N-[(4S)-thiochroman-4-yl]propanamide CAS Name: (2R)-2-(4-chlorophenoxy)-N-[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]propanamide IUPAC Name: (2R)-2-(4-chlorophenoxy)-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]propanamide Traditional Name: (2R)-2-(4-chlorophenoxy)-N-[(4S)-thiochroman-4-yl]propionamide Formula: C18H18ClNO2S MolecularWeight: 347.85902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCSC2=CC=CC=C12)OC3=CC=C(C=C3)Cl

Isomeric SMILES

C[C@H](C(=O)N[C@H]1CCSC2=CC=CC=C12)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H18ClNO2S/c1-12(22-14-8-6-13(19)7-9-14)18(21)20-16-10-11-23-17-5-3-2-4-15(16)17/h2-9,12,16H,10-11H2,1H3,(H,20,21)/t12-,16+/m1/s1