1-(3-isothiocyanatopropyl)-4-methyl-benzene

Systemtic Name: 1-(3-isothiocyanatopropyl)-4-methyl-benzene Openeye Name: 1-(3-isothiocyanatopropyl)-4-methyl-benzene CAS Name: 1-(3-isothiocyanatopropyl)-4-methylbenzene IUPAC Name: 1-(3-isothiocyanatopropyl)-4-methylbenzene Traditional Name: 1-(3-isothiocyanatopropyl)-4-methyl-benzene Formula: C11H13NS MolecularWeight: 191.29262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCCN=C=S

Isomeric SMILES

CC1=CC=C(C=C1)CCCN=C=S

InChI

InChI=1S/C11H13NS/c1-10-4-6-11(7-5-10)3-2-8-12-9-13/h4-7H,2-3,8H2,1H3