3-(5-chloranyl-2-methyl-2H-1,3-benzothiazol-3-yl)propanal

Systemtic Name: 3-(5-chloranyl-2-methyl-2H-1,3-benzothiazol-3-yl)propanal Openeye Name: 3-(5-chloro-2-methyl-2H-1,3-benzothiazol-3-yl)propanal CAS Name: 3-(5-chloro-2-methyl-2H-1,3-benzothiazol-3-yl)propanal IUPAC Name: 3-(5-chloro-2-methyl-2H-1,3-benzothiazol-3-yl)propanal Traditional Name: 3-(5-chloro-2-methyl-2H-1,3-benzothiazol-3-yl)propionaldehyde Formula: C11H12ClNOS MolecularWeight: 241.73708

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Descriptors Computed from Structure

Canonical SMILES:

CC1N(C2=C(S1)C=CC(=C2)Cl)CCC=O

Isomeric SMILES

CC1N(C2=C(S1)C=CC(=C2)Cl)CCC=O

InChI

InChI=1S/C11H12ClNOS/c1-8-13(5-2-6-14)10-7-9(12)3-4-11(10)15-8/h3-4,6-8H,2,5H2,1H3