methyl N'-phenyl-N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]carbamimidothioate hydroiodide

Systemtic Name: methyl N'-phenyl-N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]carbamimidothioate hydroiodide Openeye Name: 2-methyl-3-phenyl-1-[(E)-[(E)-3-phenylprop-2-enylidene]amino]isothiourea hydroiodide CAS Name: N'-phenyl-N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]carbamimidothioic acid methyl ester hydroiodide IUPAC Name: methyl N'-phenyl-N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]carbamimidothioate hydroiodide Traditional Name: 2-methyl-3-phenyl-1-[(E)-[(E)-3-phenylprop-2-enylidene]amino]isothiourea hydroiodide Formula: C17H18IN3S MolecularWeight: 423.31439

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC1=CC=CC=C1)NN=CC=CC2=CC=CC=C2.I

Isomeric SMILES

CSC(=NC1=CC=CC=C1)N/N=C/C=C/C2=CC=CC=C2.I

InChI

InChI=1S/C17H17N3S.HI/c1-21-17(19-16-12-6-3-7-13-16)20-18-14-8-11-15-9-4-2-5-10-15;/h2-14H,1H3,(H,19,20);1H/b11-8+,18-14+;