1-cyclopentyl-3-ethyl-2-isothiocyanato-benzene

Systemtic Name: 1-cyclopentyl-3-ethyl-2-isothiocyanato-benzene Openeye Name: 1-cyclopentyl-3-ethyl-2-isothiocyanato-benzene CAS Name: 1-cyclopentyl-3-ethyl-2-isothiocyanatobenzene IUPAC Name: 1-cyclopentyl-3-ethyl-2-isothiocyanatobenzene Traditional Name: 1-cyclopentyl-3-ethyl-2-isothiocyanato-benzene Formula: C14H17NS MolecularWeight: 231.35648

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1N=C=S)C2CCCC2

Isomeric SMILES

CCC1=CC=CC(=C1N=C=S)C2CCCC2

InChI

InChI=1S/C14H17NS/c1-2-11-8-5-9-13(14(11)15-10-16)12-6-3-4-7-12/h5,8-9,12H,2-4,6-7H2,1H3