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

Systemtic Name: 3-bromanyl-4-methoxy-N-[(2-methyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]benzamide Openeye Name: 3-bromo-4-methoxy-N-[(2-methyltetrazol-5-yl)carbamothioyl]benzamide CAS Name: 3-bromo-4-methoxy-N-[[(2-methyl-5-tetrazolyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-methoxy-N-[(2-methyltetrazol-5-yl)carbamothioyl]benzamide Traditional Name: 3-bromo-4-methoxy-N-[(2-methyltetrazol-5-yl)thiocarbamoyl]benzamide Formula: C11H11BrN6O2S MolecularWeight: 371.21304

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Descriptors Computed from Structure

Canonical SMILES:

CN1N=C(N=N1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CN1N=C(N=N1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C11H11BrN6O2S/c1-18-16-10(15-17-18)14-11(21)13-9(19)6-3-4-8(20-2)7(12)5-6/h3-5H,1-2H3,(H2,13,14,16,19,21)