3-[[1-(4-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-1-morpholin-4-yl-propan-1-one

Systemtic Name: 3-[[1-(4-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-1-morpholin-4-yl-propan-1-one Openeye Name: 1-morpholino-3-[1-(p-tolyl)tetrazol-5-yl]sulfanyl-propan-1-one CAS Name: 3-[[1-(4-methylphenyl)-5-tetrazolyl]thio]-1-(4-morpholinyl)-1-propanone IUPAC Name: 3-[1-(4-methylphenyl)tetrazol-5-yl]sulfanyl-1-morpholin-4-ylpropan-1-one Traditional Name: 1-morpholino-3-[[1-(p-tolyl)tetrazol-5-yl]thio]propan-1-one Formula: C15H19N5O2S MolecularWeight: 333.40866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=N2)SCCC(=O)N3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=N2)SCCC(=O)N3CCOCC3

InChI

InChI=1S/C15H19N5O2S/c1-12-2-4-13(5-3-12)20-15(16-17-18-20)23-11-6-14(21)19-7-9-22-10-8-19/h2-5H,6-11H2,1H3