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

Systemtic Name: (2S)-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3-thiophen-2-yl-propanal Openeye Name: (2S)-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3-(2-thienyl)propanal CAS Name: (2S)-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3-thiophen-2-ylpropanal IUPAC Name: (2S)-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3-thiophen-2-ylpropanal Traditional Name: (2S)-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3-(2-thienyl)propionaldehyde Formula: C14H15NOS2 MolecularWeight: 277.405

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)C(CC3=CC=CS3)C=O

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)[C@@H](CC3=CC=CS3)C=O

InChI

InChI=1S/C14H15NOS2/c16-9-10(8-11-4-3-7-17-11)14-15-12-5-1-2-6-13(12)18-14/h3-4,7,9-10H,1-2,5-6,8H2/t10-/m0/s1