N-[[2-(2-methylpropyl)-1,2,3,4-tetrazol-5-yl]carbamothioyl]hexanamide

Systemtic Name: N-[[2-(2-methylpropyl)-1,2,3,4-tetrazol-5-yl]carbamothioyl]hexanamide Openeye Name: N-[(2-isobutyltetrazol-5-yl)carbamothioyl]hexanamide CAS Name: N-[[[2-(2-methylpropyl)-5-tetrazolyl]amino]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[[2-(2-methylpropyl)tetrazol-5-yl]carbamothioyl]hexanamide Traditional Name: N-[(2-isobutyltetrazol-5-yl)thiocarbamoyl]hexanamide Formula: C12H22N6OS MolecularWeight: 298.40768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=NN(N=N1)CC(C)C

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=NN(N=N1)CC(C)C

InChI

InChI=1S/C12H22N6OS/c1-4-5-6-7-10(19)13-12(20)14-11-15-17-18(16-11)8-9(2)3/h9H,4-8H2,1-3H3,(H2,13,14,16,19,20)