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

Systemtic Name: 3-bromanyl-N-[(2-ethyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]-4-methoxy-benzamide Openeye Name: 3-bromo-N-[(2-ethyltetrazol-5-yl)carbamothioyl]-4-methoxy-benzamide CAS Name: 3-bromo-N-[[(2-ethyl-5-tetrazolyl)amino]-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: 3-bromo-N-[(2-ethyltetrazol-5-yl)carbamothioyl]-4-methoxybenzamide Traditional Name: 3-bromo-N-[(2-ethyltetrazol-5-yl)thiocarbamoyl]-4-methoxy-benzamide Formula: C12H13BrN6O2S MolecularWeight: 385.23962

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Descriptors Computed from Structure

Canonical SMILES:

CCN1N=C(N=N1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CCN1N=C(N=N1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C12H13BrN6O2S/c1-3-19-17-11(16-18-19)15-12(22)14-10(20)7-4-5-9(21-2)8(13)6-7/h4-6H,3H2,1-2H3,(H2,14,15,17,20,22)