methyl 4-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]butanoate

Systemtic Name: methyl 4-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]butanoate Openeye Name: methyl 4-(1-cyclopropyltetrazol-5-yl)sulfanylbutanoate CAS Name: 4-[(1-cyclopropyl-5-tetrazolyl)thio]butanoic acid methyl ester IUPAC Name: methyl 4-(1-cyclopropyltetrazol-5-yl)sulfanylbutanoate Traditional Name: 4-[(1-cyclopropyltetrazol-5-yl)thio]butyric acid methyl ester Formula: C9H14N4O2S MolecularWeight: 242.29806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCSC1=NN=NN1C2CC2

Isomeric SMILES

COC(=O)CCCSC1=NN=NN1C2CC2

InChI

InChI=1S/C9H14N4O2S/c1-15-8(14)3-2-6-16-9-10-11-12-13(9)7-4-5-7/h7H,2-6H2,1H3