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

Systemtic Name: 3-chloranyl-N-[(2-ethyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]benzamide Openeye Name: 3-chloro-N-[(2-ethyltetrazol-5-yl)carbamothioyl]benzamide CAS Name: 3-chloro-N-[[(2-ethyl-5-tetrazolyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-chloro-N-[(2-ethyltetrazol-5-yl)carbamothioyl]benzamide Traditional Name: 3-chloro-N-[(2-ethyltetrazol-5-yl)thiocarbamoyl]benzamide Formula: C11H11ClN6OS MolecularWeight: 310.76264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11ClN6OS/c1-2-18-16-10(15-17-18)14-11(20)13-9(19)7-4-3-5-8(12)6-7/h3-6H,2H2,1H3,(H2,13,14,16,19,20)