2-[(4-isothiocyanatophenyl)methyl]-4,5-dihydro-1H-imidazole

Systemtic Name: 2-[(4-isothiocyanatophenyl)methyl]-4,5-dihydro-1H-imidazole Openeye Name: 2-[(4-isothiocyanatophenyl)methyl]-4,5-dihydro-1H-imidazole CAS Name: 2-[(4-isothiocyanatophenyl)methyl]-4,5-dihydro-1H-imidazole IUPAC Name: 2-[(4-isothiocyanatophenyl)methyl]-4,5-dihydro-1H-imidazole Traditional Name: 2-(4-isothiocyanatobenzyl)-2-imidazoline Formula: C11H11N3S MolecularWeight: 217.29014

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(N1)CC2=CC=C(C=C2)N=C=S

Isomeric SMILES

C1CN=C(N1)CC2=CC=C(C=C2)N=C=S

InChI

InChI=1S/C11H11N3S/c15-8-14-10-3-1-9(2-4-10)7-11-12-5-6-13-11/h1-4H,5-7H2,(H,12,13)