3-[3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,2,3,4-tetrazol-1-yl]propanethioic S-acid

Systemtic Name: 3-[3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,2,3,4-tetrazol-1-yl]propanethioic S-acid Openeye Name: 3-[2-(tert-butoxycarbonylamino)-3-methyl-tetrazol-1-yl]propanethioic S-acid CAS Name: 3-[3-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-tetrazolyl]propanethioic S-acid IUPAC Name: 3-[3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]tetrazol-1-yl]propanethioic S-acid Traditional Name: 3-[2-(tert-butoxycarbonylamino)-3-methyl-tetrazol-1-yl]thiopropionic acid Formula: C10H19N5O3S MolecularWeight: 289.35456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN1N(N=CN1CCC(=O)S)C

Isomeric SMILES

CC(C)(C)OC(=O)NN1N(N=CN1CCC(=O)S)C

InChI

InChI=1S/C10H19N5O3S/c1-10(2,3)18-9(17)12-15-13(4)11-7-14(15)6-5-8(16)19/h7H,5-6H2,1-4H3,(H,12,17)(H,16,19)