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

Systemtic Name: 4-tert-butyl-N-[(2-methyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]benzamide Openeye Name: 4-tert-butyl-N-[(2-methyltetrazol-5-yl)carbamothioyl]benzamide CAS Name: 4-tert-butyl-N-[[(2-methyl-5-tetrazolyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-[(2-methyltetrazol-5-yl)carbamothioyl]benzamide Traditional Name: 4-tert-butyl-N-[(2-methyltetrazol-5-yl)thiocarbamoyl]benzamide Formula: C14H18N6OS MolecularWeight: 318.39732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N6OS/c1-14(2,3)10-7-5-9(6-8-10)11(21)15-13(22)16-12-17-19-20(4)18-12/h5-8H,1-4H3,(H2,15,16,18,21,22)