2-[1-(isothiocyanatomethyl)cyclopropyl]-4-methyl-aniline

Systemtic Name: 2-[1-(isothiocyanatomethyl)cyclopropyl]-4-methyl-aniline Openeye Name: 2-[1-(isothiocyanatomethyl)cyclopropyl]-4-methyl-aniline CAS Name: 2-[1-(isothiocyanatomethyl)cyclopropyl]-4-methylaniline IUPAC Name: 2-[1-(isothiocyanatomethyl)cyclopropyl]-4-methylaniline Traditional Name: [2-[1-(isothiocyanatomethyl)cyclopropyl]-4-methyl-phenyl]amine Formula: C12H14N2S MolecularWeight: 218.31796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N)C2(CC2)CN=C=S

Isomeric SMILES

CC1=CC(=C(C=C1)N)C2(CC2)CN=C=S

InChI

InChI=1S/C12H14N2S/c1-9-2-3-11(13)10(6-9)12(4-5-12)7-14-8-15/h2-3,6H,4-5,7,13H2,1H3