3-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-(1-cyclopropyltetrazol-5-yl)sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one CAS Name: 3-[(1-cyclopropyl-5-tetrazolyl)thio]-1-[4-(2-pyrimidinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(1-cyclopropyltetrazol-5-yl)sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-[(1-cyclopropyltetrazol-5-yl)thio]-1-[4-(2-pyrimidyl)piperazino]propan-1-one Formula: C15H20N8OS MolecularWeight: 360.4373

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=N2)SCCC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1CC1N2C(=NN=N2)SCCC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C15H20N8OS/c24-13(4-11-25-15-18-19-20-23(15)12-2-3-12)21-7-9-22(10-8-21)14-16-5-1-6-17-14/h1,5-6,12H,2-4,7-11H2