(E)-1-(5-methyl-1,2,3,4-tetrazol-1-yl)-4-sulfanyl-but-3-en-2-one

Systemtic Name: (E)-1-(5-methyl-1,2,3,4-tetrazol-1-yl)-4-sulfanyl-but-3-en-2-one Openeye Name: (E)-1-(5-methyltetrazol-1-yl)-4-sulfanyl-but-3-en-2-one CAS Name: (E)-4-mercapto-1-(5-methyl-1-tetrazolyl)-3-buten-2-one IUPAC Name: (E)-1-(5-methyltetrazol-1-yl)-4-sulfanylbut-3-en-2-one Traditional Name: (E)-4-mercapto-1-(5-methyltetrazol-1-yl)but-3-en-2-one Formula: C6H8N4OS MolecularWeight: 184.21892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=NN1CC(=O)C=CS

Isomeric SMILES

CC1=NN=NN1CC(=O)/C=C/S

InChI

InChI=1S/C6H8N4OS/c1-5-7-8-9-10(5)4-6(11)2-3-12/h2-3,12H,4H2,1H3/b3-2+