3-sulfanylpropyl N'-cyano-N-phenylazanyl-carbamimidothioate

Systemtic Name: 3-sulfanylpropyl N'-cyano-N-phenylazanyl-carbamimidothioate Openeye Name: 1-anilino-3-cyano-2-(3-sulfanylpropyl)isothiourea CAS Name: N-anilino-N'-cyanocarbamimidothioic acid 3-mercaptopropyl ester IUPAC Name: 3-sulfanylpropyl N-anilino-N'-cyanocarbamimidothioate Traditional Name: 1-anilino-3-cyano-2-(3-mercaptopropyl)isothiourea Formula: C11H14N4S2 MolecularWeight: 266.38566

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NNC(=NC#N)SCCCS

Isomeric SMILES

C1=CC=C(C=C1)NNC(=NC#N)SCCCS

InChI

InChI=1S/C11H14N4S2/c12-9-13-11(17-8-4-7-16)15-14-10-5-2-1-3-6-10/h1-3,5-6,14,16H,4,7-8H2,(H,13,15)