(2S)-3-phenyl-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanal

Systemtic Name: (2S)-3-phenyl-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanal Openeye Name: (2S)-3-phenyl-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanal CAS Name: (2S)-3-phenyl-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanal IUPAC Name: (2S)-3-phenyl-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanal Traditional Name: (2S)-3-phenyl-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propionaldehyde Formula: C16H17NOS MolecularWeight: 271.37728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)C(CC3=CC=CC=C3)C=O

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)[C@@H](CC3=CC=CC=C3)C=O

InChI

InChI=1S/C16H17NOS/c18-11-13(10-12-6-2-1-3-7-12)16-17-14-8-4-5-9-15(14)19-16/h1-3,6-7,11,13H,4-5,8-10H2/t13-/m0/s1