5-(2-pyridin-4-yl-2H-1,3-thiazol-3-yl)-3H-1,2-benzodioxole-4-carbaldehyde

Systemtic Name: 5-(2-pyridin-4-yl-2H-1,3-thiazol-3-yl)-3H-1,2-benzodioxole-4-carbaldehyde Openeye Name: 5-[2-(4-pyridyl)-2H-thiazol-3-yl]-3H-1,2-benzodioxole-4-carbaldehyde CAS Name: 5-(2-pyridin-4-yl-2H-thiazol-3-yl)-3H-1,2-benzodioxole-4-carboxaldehyde IUPAC Name: 5-(2-pyridin-4-yl-2H-1,3-thiazol-3-yl)-3H-1,2-benzodioxole-4-carbaldehyde Traditional Name: 5-[2-(4-pyridyl)-4-thiazolin-3-yl]-3H-1,2-benzodioxole-4-carbaldehyde Formula: C16H12N2O3S MolecularWeight: 312.34308

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2C=O)N3C=CSC3C4=CC=NC=C4)OO1

Isomeric SMILES

C1C2=C(C=CC(=C2C=O)N3C=CSC3C4=CC=NC=C4)OO1

InChI

InChI=1S/C16H12N2O3S/c19-9-12-13-10-20-21-15(13)2-1-14(12)18-7-8-22-16(18)11-3-5-17-6-4-11/h1-9,16H,10H2