3-(5-chloranyl-2-sulfanylidene-1,3-benzothiazol-3-yl)propanamide

Systemtic Name: 3-(5-chloranyl-2-sulfanylidene-1,3-benzothiazol-3-yl)propanamide Openeye Name: 3-(5-chloro-2-thioxo-1,3-benzothiazol-3-yl)propanamide CAS Name: 3-(5-chloro-2-sulfanylidene-1,3-benzothiazol-3-yl)propanamide IUPAC Name: 3-(5-chloro-2-sulfanylidene-1,3-benzothiazol-3-yl)propanamide Traditional Name: 3-(5-chloro-2-thioxo-1,3-benzothiazol-3-yl)propionamide Formula: C10H9ClN2OS2 MolecularWeight: 272.77426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)N(C(=S)S2)CCC(=O)N

Isomeric SMILES

C1=CC2=C(C=C1Cl)N(C(=S)S2)CCC(=O)N

InChI

InChI=1S/C10H9ClN2OS2/c11-6-1-2-8-7(5-6)13(10(15)16-8)4-3-9(12)14/h1-2,5H,3-4H2,(H2,12,14)