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

Systemtic Name: (2S)-3-pyridin-2-yl-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanal Openeye Name: (2S)-3-(2-pyridyl)-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanal CAS Name: (2S)-3-(2-pyridinyl)-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanal IUPAC Name: (2S)-3-pyridin-2-yl-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanal Traditional Name: (2S)-3-(2-pyridyl)-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propionaldehyde Formula: C15H16N2OS MolecularWeight: 272.36534

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)C(CC3=CC=CC=N3)C=O

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)[C@@H](CC3=CC=CC=N3)C=O

InChI

InChI=1S/C15H16N2OS/c18-10-11(9-12-5-3-4-8-16-12)15-17-13-6-1-2-7-14(13)19-15/h3-5,8,10-11H,1-2,6-7,9H2/t11-/m0/s1