N-ethyl-N-(3-isothiocyanatopropyl)aniline

Systemtic Name: N-ethyl-N-(3-isothiocyanatopropyl)aniline Openeye Name: N-ethyl-N-(3-isothiocyanatopropyl)aniline CAS Name: N-ethyl-N-(3-isothiocyanatopropyl)aniline IUPAC Name: N-ethyl-N-(3-isothiocyanatopropyl)aniline Traditional Name: ethyl-(3-isothiocyanatopropyl)-phenyl-amine Formula: C12H16N2S MolecularWeight: 220.33384

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCN=C=S)C1=CC=CC=C1

Isomeric SMILES

CCN(CCCN=C=S)C1=CC=CC=C1

InChI

InChI=1S/C12H16N2S/c1-2-14(10-6-9-13-11-15)12-7-4-3-5-8-12/h3-5,7-8H,2,6,9-10H2,1H3