2-[[4-(3-fluorophenyl)-5-sulfanylidene-1,2,3,4-tetrazol-1-yl]methyl-methyl-amino]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[[4-(3-fluorophenyl)-5-sulfanylidene-1,2,3,4-tetrazol-1-yl]methyl-methyl-amino]-N-propan-2-yl-ethanamide Openeye Name: 2-[[4-(3-fluorophenyl)-5-thioxo-tetrazol-1-yl]methyl-methyl-amino]-N-isopropyl-acetamide CAS Name: 2-[[4-(3-fluorophenyl)-5-sulfanylidene-1-tetrazolyl]methyl-methylamino]-N-propan-2-ylacetamide IUPAC Name: 2-[[4-(3-fluorophenyl)-5-sulfanylidenetetrazol-1-yl]methyl-methylamino]-N-propan-2-ylacetamide Traditional Name: 2-[[4-(3-fluorophenyl)-5-thioxo-tetrazol-1-yl]methyl-methyl-amino]-N-isopropyl-acetamide Formula: C14H19FN6OS MolecularWeight: 338.403663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN(C)CN1C(=S)N(N=N1)C2=CC(=CC=C2)F

Isomeric SMILES

CC(C)NC(=O)CN(C)CN1C(=S)N(N=N1)C2=CC(=CC=C2)F

InChI

InChI=1S/C14H19FN6OS/c1-10(2)16-13(22)8-19(3)9-20-14(23)21(18-17-20)12-6-4-5-11(15)7-12/h4-7,10H,8-9H2,1-3H3,(H,16,22)