1-isothiocyanatobutylbenzene

Systemtic Name: 1-isothiocyanatobutylbenzene Openeye Name: 1-isothiocyanatobutylbenzene CAS Name: 1-isothiocyanatobutylbenzene IUPAC Name: 1-isothiocyanatobutylbenzene Traditional Name: 1-isothiocyanatobutylbenzene Formula: C11H13NS MolecularWeight: 191.29262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NS/c1-2-6-11(12-9-13)10-7-4-3-5-8-10/h3-5,7-8,11H,2,6H2,1H3