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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)CSC1=NN=NN1C2CC2

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)CSC1=NN=NN1C2CC2

InChI

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