(E)-N-[(2-methyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[(2-methyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[(2-methyltetrazol-5-yl)carbamothioyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[[(2-methyl-5-tetrazolyl)amino]-sulfanylidenemethyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[(2-methyltetrazol-5-yl)carbamothioyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[(2-methyltetrazol-5-yl)thiocarbamoyl]-3-phenyl-acrylamide Formula: C12H12N6OS MolecularWeight: 288.32828

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Descriptors Computed from Structure

Canonical SMILES:

CN1N=C(N=N1)NC(=S)NC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C12H12N6OS/c1-18-16-11(15-17-18)14-12(20)13-10(19)8-7-9-5-3-2-4-6-9/h2-8H,1H3,(H2,13,14,16,19,20)/b8-7+