1-[(4-methoxyphenyl)methyl]-3-[(2-nitro-4-sulfamoyl-phenyl)amino]thiourea

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-3-[(2-nitro-4-sulfamoyl-phenyl)amino]thiourea Openeye Name: 1-[(4-methoxyphenyl)methyl]-3-(2-nitro-4-sulfamoyl-anilino)thiourea CAS Name: 1-[(4-methoxyphenyl)methyl]-3-(2-nitro-4-sulfamoylanilino)thiourea IUPAC Name: 1-[(4-methoxyphenyl)methyl]-3-(2-nitro-4-sulfamoylanilino)thiourea Traditional Name: 1-(2-nitro-4-sulfamoyl-anilino)-3-p-anisyl-thiourea Formula: C15H17N5O5S2 MolecularWeight: 411.45598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)NNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)NNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C15H17N5O5S2/c1-25-11-4-2-10(3-5-11)9-17-15(26)19-18-13-7-6-12(27(16,23)24)8-14(13)20(21)22/h2-8,18H,9H2,1H3,(H2,16,23,24)(H2,17,19,26)