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[cyano-(3-phenoxyphenyl)methyl] carbamimidothioate hydrochloride

[cyano-(3-phenoxyphenyl)methyl] carbamimidothioate hydrochloride

Systemtic Name:[cyano-(3-phenoxyphenyl)methyl] carbamimidothioate hydrochloride
Openeye Name:2-[cyano-(3-phenoxyphenyl)methyl]isothiourea hydrochloride
CAS Name:carbamimidothioic acid [cyano-(3-phenoxyphenyl)methyl] ester hydrochloride
IUPAC Name:[cyano-(3-phenoxyphenyl)methyl] carbamimidothioate hydrochloride
Traditional Name:2-[cyano-(3-phenoxyphenyl)methyl]isothiourea hydrochloride
Formula: C15H14ClN3OS
MolecularWeight: 319.80916
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)C(C#N)SC(=N)N.Cl


Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)C(C#N)SC(=N)N.Cl


InChI

InChI=1S/C15H13N3OS.ClH/c16-10-14(20-15(17)18)11-5-4-8-13(9-11)19-12-6-2-1-3-7-12;/h1-9,14H,(H3,17,18);1H


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