3-[1,3-benzothiazol-2-yl(methyl)amino]propanethioamide

Systemtic Name: 3-[1,3-benzothiazol-2-yl(methyl)amino]propanethioamide Openeye Name: 3-[1,3-benzothiazol-2-yl(methyl)amino]propanethioamide CAS Name: 3-[1,3-benzothiazol-2-yl(methyl)amino]propanethioamide IUPAC Name: 3-[1,3-benzothiazol-2-yl(methyl)amino]propanethioamide Traditional Name: 3-[1,3-benzothiazol-2-yl(methyl)amino]thiopropionamide Formula: C11H13N3S2 MolecularWeight: 251.37102

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=S)N)C1=NC2=CC=CC=C2S1

Isomeric SMILES

CN(CCC(=S)N)C1=NC2=CC=CC=C2S1

InChI

InChI=1S/C11H13N3S2/c1-14(7-6-10(12)15)11-13-8-4-2-3-5-9(8)16-11/h2-5H,6-7H2,1H3,(H2,12,15)