S-methyl 4-(1-methyl-1,2,3,4-tetrazol-5-yl)pentanethioate

Systemtic Name: S-methyl 4-(1-methyl-1,2,3,4-tetrazol-5-yl)pentanethioate Openeye Name: S-methyl 4-(1-methyltetrazol-5-yl)pentanethioate CAS Name: 4-(1-methyl-5-tetrazolyl)pentanethioic acid S-methyl ester IUPAC Name: S-methyl 4-(1-methyltetrazol-5-yl)pentanethioate Traditional Name: 4-(1-methyltetrazol-5-yl)pentanethioic acid S-methyl ester Formula: C8H14N4OS MolecularWeight: 214.28796

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)SC)C1=NN=NN1C

Isomeric SMILES

CC(CCC(=O)SC)C1=NN=NN1C

InChI

InChI=1S/C8H14N4OS/c1-6(4-5-7(13)14-3)8-9-10-11-12(8)2/h6H,4-5H2,1-3H3