2,6-diethyl-3-isothiocyanato-4-methyl-aniline

Systemtic Name: 2,6-diethyl-3-isothiocyanato-4-methyl-aniline Openeye Name: 2,6-diethyl-3-isothiocyanato-4-methyl-aniline CAS Name: 2,6-diethyl-3-isothiocyanato-4-methylaniline IUPAC Name: 2,6-diethyl-3-isothiocyanato-4-methylaniline Traditional Name: (2,6-diethyl-3-isothiocyanato-4-methyl-phenyl)amine Formula: C12H16N2S MolecularWeight: 220.33384

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C(=C1)C)N=C=S)CC)N

Isomeric SMILES

CCC1=C(C(=C(C(=C1)C)N=C=S)CC)N

InChI

InChI=1S/C12H16N2S/c1-4-9-6-8(3)12(14-7-15)10(5-2)11(9)13/h6H,4-5,13H2,1-3H3