1,3-diethyl-2-isothiocyanato-5-methyl-benzene

Systemtic Name: 1,3-diethyl-2-isothiocyanato-5-methyl-benzene Openeye Name: 1,3-diethyl-2-isothiocyanato-5-methyl-benzene CAS Name: 1,3-diethyl-2-isothiocyanato-5-methylbenzene IUPAC Name: 1,3-diethyl-2-isothiocyanato-5-methylbenzene Traditional Name: 1,3-diethyl-2-isothiocyanato-5-methyl-benzene Formula: C12H15NS MolecularWeight: 205.3192

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1N=C=S)CC)C

Isomeric SMILES

CCC1=CC(=CC(=C1N=C=S)CC)C

InChI

InChI=1S/C12H15NS/c1-4-10-6-9(3)7-11(5-2)12(10)13-8-14/h6-7H,4-5H2,1-3H3