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

Systemtic Name: 3-chloranyl-4-ethoxy-N-[(2-methyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]benzamide Openeye Name: 3-chloro-4-ethoxy-N-[(2-methyltetrazol-5-yl)carbamothioyl]benzamide CAS Name: 3-chloro-4-ethoxy-N-[[(2-methyl-5-tetrazolyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-chloro-4-ethoxy-N-[(2-methyltetrazol-5-yl)carbamothioyl]benzamide Traditional Name: 3-chloro-4-ethoxy-N-[(2-methyltetrazol-5-yl)thiocarbamoyl]benzamide Formula: C12H13ClN6O2S MolecularWeight: 340.78862

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NN(N=N2)C)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NN(N=N2)C)Cl

InChI

InChI=1S/C12H13ClN6O2S/c1-3-21-9-5-4-7(6-8(9)13)10(20)14-12(22)15-11-16-18-19(2)17-11/h4-6H,3H2,1-2H3,(H2,14,15,17,20,22)