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

Systemtic Name: 3-bromanyl-4-ethoxy-N-[(1-propyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]benzamide Openeye Name: 3-bromo-4-ethoxy-N-[(1-propyltetrazol-5-yl)carbamothioyl]benzamide CAS Name: 3-bromo-4-ethoxy-N-[[(1-propyl-5-tetrazolyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-N-[(1-propyltetrazol-5-yl)carbamothioyl]benzamide Traditional Name: 3-bromo-4-ethoxy-N-[(1-propyltetrazol-5-yl)thiocarbamoyl]benzamide Formula: C14H17BrN6O2S MolecularWeight: 413.29278

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCC)Br

Isomeric SMILES

CCCN1C(=NN=N1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCC)Br

InChI

InChI=1S/C14H17BrN6O2S/c1-3-7-21-13(18-19-20-21)17-14(24)16-12(22)9-5-6-11(23-4-2)10(15)8-9/h5-6,8H,3-4,7H2,1-2H3,(H2,16,17,18,20,22,24)