(3R,3aS,7aR)-3-methylsulfanyl-1-(phenylmethyl)-3a,6,7,7a-tetrahydro-3H-indol-2-one

Systemtic Name: (3R,3aS,7aR)-3-methylsulfanyl-1-(phenylmethyl)-3a,6,7,7a-tetrahydro-3H-indol-2-one Openeye Name: (3R,3aS,7aR)-1-benzyl-3-methylsulfanyl-3a,6,7,7a-tetrahydro-3H-indol-2-one CAS Name: (3R,3aS,7aR)-3-(methylthio)-1-(phenylmethyl)-3a,6,7,7a-tetrahydro-3H-indol-2-one IUPAC Name: (3R,3aS,7aR)-1-benzyl-3-methylsulfanyl-3a,6,7,7a-tetrahydro-3H-indol-2-one Traditional Name: (3R,3aS,7aR)-1-benzyl-3-(methylthio)-3a,6,7,7a-tetrahydro-3H-indol-2-one Formula: C16H19NOS MolecularWeight: 273.39316

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Descriptors Computed from Structure

Canonical SMILES:

CSC1C2C=CCCC2N(C1=O)CC3=CC=CC=C3

Isomeric SMILES

CS[C@@H]1[C@H]2C=CCC[C@H]2N(C1=O)CC3=CC=CC=C3

InChI

InChI=1S/C16H19NOS/c1-19-15-13-9-5-6-10-14(13)17(16(15)18)11-12-7-3-2-4-8-12/h2-5,7-9,13-15H,6,10-11H2,1H3/t13-,14+,15+/m0/s1