4-[5-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-1,2,3,4-tetrazol-1-yl]benzoate

Systemtic Name: 4-[5-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-1,2,3,4-tetrazol-1-yl]benzoate Openeye Name: 4-[5-(2-morpholino-2-oxo-ethyl)sulfanyltetrazol-1-yl]benzoate CAS Name: 4-[5-[[2-(4-morpholinyl)-2-oxoethyl]thio]-1-tetrazolyl]benzoate IUPAC Name: 4-[5-(2-morpholin-4-yl-2-oxoethyl)sulfanyltetrazol-1-yl]benzoate Traditional Name: 4-[5-[(2-keto-2-morpholino-ethyl)thio]tetrazol-1-yl]benzoate Formula: C14H14N5O4S- MolecularWeight: 348.35706

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CSC2=NN=NN2C3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

C1COCCN1C(=O)CSC2=NN=NN2C3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C14H15N5O4S/c20-12(18-5-7-23-8-6-18)9-24-14-15-16-17-19(14)11-3-1-10(2-4-11)13(21)22/h1-4H,5-9H2,(H,21,22)/p-1