ethyl 4-[2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(1-cyclopropyltetrazol-5-yl)sulfanylacetyl]piperazine-1-carboxylate CAS Name: 4-[2-[(1-cyclopropyl-5-tetrazolyl)thio]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(1-cyclopropyltetrazol-5-yl)sulfanylacetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(1-cyclopropyltetrazol-5-yl)thio]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C13H20N6O3S MolecularWeight: 340.4013

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CSC2=NN=NN2C3CC3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CSC2=NN=NN2C3CC3

InChI

InChI=1S/C13H20N6O3S/c1-2-22-13(21)18-7-5-17(6-8-18)11(20)9-23-12-14-15-16-19(12)10-3-4-10/h10H,2-9H2,1H3