1-isothiocyanato-1-(4-methoxyphenyl)-N-[(4-methylphenyl)sulfonylmethyl]methanimine

Systemtic Name: 1-isothiocyanato-1-(4-methoxyphenyl)-N-[(4-methylphenyl)sulfonylmethyl]methanimine Openeye Name: (1Z)-4-methoxy-N-(p-tolylsulfonylmethyl)benzimidoyl isothiocyanate CAS Name: 1-isothiocyanato-1-(4-methoxyphenyl)-N-[(4-methylphenyl)sulfonylmethyl]methanimine IUPAC Name: (1Z)-4-methoxy-N-[(4-methylphenyl)sulfonylmethyl]benzenecarboximidoyl isothiocyanate Traditional Name: (Z)-[isothiocyanato-(4-methoxyphenyl)methylene]-(tosylmethyl)amine Formula: C17H16N2O3S2 MolecularWeight: 360.45054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CN=C(C2=CC=C(C=C2)OC)N=C=S

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C/N=C(/C2=CC=C(C=C2)OC)\N=C=S

InChI

InChI=1S/C17H16N2O3S2/c1-13-3-9-16(10-4-13)24(20,21)12-19-17(18-11-23)14-5-7-15(22-2)8-6-14/h3-10H,12H2,1-2H3/b19-17-