[4-[(2-methoxy-5-nitro-phenyl)sulfonylamino]-3-methyl-phenyl] thiocyanate

Systemtic Name: [4-[(2-methoxy-5-nitro-phenyl)sulfonylamino]-3-methyl-phenyl] thiocyanate Openeye Name: [4-[(2-methoxy-5-nitro-phenyl)sulfonylamino]-3-methyl-phenyl] thiocyanate CAS Name: thiocyanic acid [4-[(2-methoxy-5-nitrophenyl)sulfonylamino]-3-methylphenyl] ester IUPAC Name: [4-[(2-methoxy-5-nitrophenyl)sulfonylamino]-3-methylphenyl] thiocyanate Traditional Name: thiocyanic acid [4-[(2-methoxy-5-nitro-phenyl)sulfonylamino]-3-methyl-phenyl] ester Formula: C15H13N3O5S2 MolecularWeight: 379.41082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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