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

Systemtic Name: N-[[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoylamino]carbamothioyl]benzamide Openeye Name: N-[[[2-(5-phenyltetrazol-2-yl)acetyl]amino]carbamothioyl]benzamide CAS Name: N-[[[1-oxo-2-(5-phenyl-2-tetrazolyl)ethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[[2-(5-phenyltetrazol-2-yl)acetyl]amino]carbamothioyl]benzamide Traditional Name: N-[[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiocarbamoyl]benzamide Formula: C17H15N7O2S MolecularWeight: 381.4117

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(N=N2)CC(=O)NNC(=S)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(N=N2)CC(=O)NNC(=S)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H15N7O2S/c25-14(11-24-22-15(20-23-24)12-7-3-1-4-8-12)19-21-17(27)18-16(26)13-9-5-2-6-10-13/h1-10H,11H2,(H,19,25)(H2,18,21,26,27)