2-[[1-(4-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-pyrimidin-2-yl-ethanamide

Systemtic Name: 2-[[1-(4-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-pyrimidin-2-yl-ethanamide Openeye Name: 2-[1-(p-tolyl)tetrazol-5-yl]sulfanyl-N-pyrimidin-2-yl-acetamide CAS Name: 2-[[1-(4-methylphenyl)-5-tetrazolyl]thio]-N-(2-pyrimidinyl)acetamide IUPAC Name: 2-[1-(4-methylphenyl)tetrazol-5-yl]sulfanyl-N-pyrimidin-2-ylacetamide Traditional Name: 2-[[1-(p-tolyl)tetrazol-5-yl]thio]-N-(2-pyrimidyl)acetamide Formula: C14H13N7OS MolecularWeight: 327.36432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)NC3=NC=CC=N3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)NC3=NC=CC=N3

InChI

InChI=1S/C14H13N7OS/c1-10-3-5-11(6-4-10)21-14(18-19-20-21)23-9-12(22)17-13-15-7-2-8-16-13/h2-8H,9H2,1H3,(H,15,16,17,22)