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

Systemtic Name: methyl 2-[2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoylamino]-3-methyl-butanoate Openeye Name: methyl 2-[[2-(1-cyclopropyltetrazol-5-yl)sulfanylacetyl]amino]-3-methyl-butanoate CAS Name: 2-[[2-[(1-cyclopropyl-5-tetrazolyl)thio]-1-oxoethyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[[2-(1-cyclopropyltetrazol-5-yl)sulfanylacetyl]amino]-3-methylbutanoate Traditional Name: 2-[[2-[(1-cyclopropyltetrazol-5-yl)thio]acetyl]amino]-3-methyl-butyric acid methyl ester Formula: C12H19N5O3S MolecularWeight: 313.37596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)CSC1=NN=NN1C2CC2

Isomeric SMILES

CC(C)C(C(=O)OC)NC(=O)CSC1=NN=NN1C2CC2

InChI

InChI=1S/C12H19N5O3S/c1-7(2)10(11(19)20-3)13-9(18)6-21-12-14-15-16-17(12)8-4-5-8/h7-8,10H,4-6H2,1-3H3,(H,13,18)