3-bromanyl-N-[(2-butyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]-4-ethoxy-benzamide

Systemtic Name: 3-bromanyl-N-[(2-butyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]-4-ethoxy-benzamide Openeye Name: 3-bromo-N-[(2-butyltetrazol-5-yl)carbamothioyl]-4-ethoxy-benzamide CAS Name: 3-bromo-N-[[(2-butyl-5-tetrazolyl)amino]-sulfanylidenemethyl]-4-ethoxybenzamide IUPAC Name: 3-bromo-N-[(2-butyltetrazol-5-yl)carbamothioyl]-4-ethoxybenzamide Traditional Name: 3-bromo-N-[(2-butyltetrazol-5-yl)thiocarbamoyl]-4-ethoxy-benzamide Formula: C15H19BrN6O2S MolecularWeight: 427.31936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1N=C(N=N1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCC)Br

Isomeric SMILES

CCCCN1N=C(N=N1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCC)Br

InChI

InChI=1S/C15H19BrN6O2S/c1-3-5-8-22-20-14(19-21-22)18-15(25)17-13(23)10-6-7-12(24-4-2)11(16)9-10/h6-7,9H,3-5,8H2,1-2H3,(H2,17,18,20,23,25)