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

Systemtic Name: 3-[[1-(4-methoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-1-piperidin-1-yl-propan-1-one Openeye Name: 3-[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanyl-1-(1-piperidyl)propan-1-one CAS Name: 3-[[1-(4-methoxyphenyl)-5-tetrazolyl]thio]-1-(1-piperidinyl)-1-propanone IUPAC Name: 3-[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanyl-1-piperidin-1-ylpropan-1-one Traditional Name: 3-[[1-(4-methoxyphenyl)tetrazol-5-yl]thio]-1-piperidino-propan-1-one Formula: C16H21N5O2S MolecularWeight: 347.43524

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NN=N2)SCCC(=O)N3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NN=N2)SCCC(=O)N3CCCCC3

InChI

InChI=1S/C16H21N5O2S/c1-23-14-7-5-13(6-8-14)21-16(17-18-19-21)24-12-9-15(22)20-10-3-2-4-11-20/h5-8H,2-4,9-12H2,1H3