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

Systemtic Name: 4-[5-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-1,2,3,4-tetrazol-1-yl]benzoic acid Openeye Name: 4-[5-(2-morpholino-2-oxo-ethyl)sulfanyltetrazol-1-yl]benzoic acid CAS Name: 4-[5-[[2-(4-morpholinyl)-2-oxoethyl]thio]-1-tetrazolyl]benzoic acid IUPAC Name: 4-[5-(2-morpholin-4-yl-2-oxoethyl)sulfanyltetrazol-1-yl]benzoic acid Traditional Name: 4-[5-[(2-keto-2-morpholino-ethyl)thio]tetrazol-1-yl]benzoic acid Formula: C14H15N5O4S MolecularWeight: 349.365

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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)