(3R)-3-[(S)-(4-chlorophenyl)-phenylazanyl-methyl]thian-4-one

Systemtic Name: (3R)-3-[(S)-(4-chlorophenyl)-phenylazanyl-methyl]thian-4-one Openeye Name: (3R)-3-[(S)-anilino-(4-chlorophenyl)methyl]tetrahydrothiopyran-4-one CAS Name: (3R)-3-[(S)-anilino-(4-chlorophenyl)methyl]-4-thianone IUPAC Name: (3R)-3-[(S)-anilino-(4-chlorophenyl)methyl]thian-4-one Traditional Name: (3R)-3-[(S)-anilino-(4-chlorophenyl)methyl]tetrahydrothiopyran-4-one Formula: C18H18ClNOS MolecularWeight: 331.85962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSCC(C1=O)C(C2=CC=C(C=C2)Cl)NC3=CC=CC=C3

Isomeric SMILES

C1CSC[C@@H](C1=O)[C@@H](C2=CC=C(C=C2)Cl)NC3=CC=CC=C3

InChI

InChI=1S/C18H18ClNOS/c19-14-8-6-13(7-9-14)18(16-12-22-11-10-17(16)21)20-15-4-2-1-3-5-15/h1-9,16,18,20H,10-12H2/t16-,18+/m0/s1