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

Systemtic Name: 3-ethenylsulfonyl-N-[3-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)phenyl]propanamide Openeye Name: N-[3-(5-thioxo-2H-tetrazol-1-yl)phenyl]-3-vinylsulfonyl-propanamide CAS Name: 3-ethenylsulfonyl-N-[3-(5-sulfanylidene-2H-tetrazol-1-yl)phenyl]propanamide IUPAC Name: 3-ethenylsulfonyl-N-[3-(5-sulfanylidene-2H-tetrazol-1-yl)phenyl]propanamide Traditional Name: N-[3-(5-thioxo-2H-tetrazol-1-yl)phenyl]-3-vinylsulfonyl-propionamide Formula: C12H13N5O3S2 MolecularWeight: 339.39332

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Descriptors Computed from Structure

Canonical SMILES:

C=CS(=O)(=O)CCC(=O)NC1=CC=CC(=C1)N2C(=S)N=NN2

Isomeric SMILES

C=CS(=O)(=O)CCC(=O)NC1=CC=CC(=C1)N2C(=S)N=NN2

InChI

InChI=1S/C12H13N5O3S2/c1-2-22(19,20)7-6-11(18)13-9-4-3-5-10(8-9)17-12(21)14-15-16-17/h2-5,8H,1,6-7H2,(H,13,18)(H,14,16,21)