[4-[(4-methoxy-3-nitro-phenyl)sulfonylamino]-3-methyl-phenyl] thiocyanate

Systemtic Name: [4-[(4-methoxy-3-nitro-phenyl)sulfonylamino]-3-methyl-phenyl] thiocyanate Openeye Name: [4-[(4-methoxy-3-nitro-phenyl)sulfonylamino]-3-methyl-phenyl] thiocyanate CAS Name: thiocyanic acid [4-[(4-methoxy-3-nitrophenyl)sulfonylamino]-3-methylphenyl] ester IUPAC Name: [4-[(4-methoxy-3-nitrophenyl)sulfonylamino]-3-methylphenyl] thiocyanate Traditional Name: thiocyanic acid [4-[(4-methoxy-3-nitro-phenyl)sulfonylamino]-3-methyl-phenyl] ester Formula: C15H13N3O5S2 MolecularWeight: 379.41082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SC#N)NS(=O)(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)SC#N)NS(=O)(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C15H13N3O5S2/c1-10-7-11(24-9-16)3-5-13(10)17-25(21,22)12-4-6-15(23-2)14(8-12)18(19)20/h3-8,17H,1-2H3