2-methyl-N-[3-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)phenyl]propanethioamide

Systemtic Name: 2-methyl-N-[3-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)phenyl]propanethioamide Openeye Name: 2-methyl-N-[3-(5-thioxo-2H-tetrazol-1-yl)phenyl]propanethioamide CAS Name: 2-methyl-N-[3-(5-sulfanylidene-2H-tetrazol-1-yl)phenyl]propanethioamide IUPAC Name: 2-methyl-N-[3-(5-sulfanylidene-2H-tetrazol-1-yl)phenyl]propanethioamide Traditional Name: 2-methyl-N-[3-(5-thioxo-2H-tetrazol-1-yl)phenyl]thiopropionamide Formula: C11H13N5S2 MolecularWeight: 279.38442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=S)NC1=CC=CC(=C1)N2C(=S)N=NN2

Isomeric SMILES

CC(C)C(=S)NC1=CC=CC(=C1)N2C(=S)N=NN2

InChI

InChI=1S/C11H13N5S2/c1-7(2)10(17)12-8-4-3-5-9(6-8)16-11(18)13-14-15-16/h3-7H,1-2H3,(H,12,17)(H,13,15,18)