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

Systemtic Name: 1-[(2-nitro-4-sulfamoyl-phenyl)amino]-3-phenyl-thiourea Openeye Name: 1-(2-nitro-4-sulfamoyl-anilino)-3-phenyl-thiourea CAS Name: 1-(2-nitro-4-sulfamoylanilino)-3-phenylthiourea IUPAC Name: 1-(2-nitro-4-sulfamoylanilino)-3-phenylthiourea Traditional Name: 1-(2-nitro-4-sulfamoyl-anilino)-3-phenyl-thiourea Formula: C13H13N5O4S2 MolecularWeight: 367.40342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13N5O4S2/c14-24(21,22)10-6-7-11(12(8-10)18(19)20)16-17-13(23)15-9-4-2-1-3-5-9/h1-8,16H,(H2,14,21,22)(H2,15,17,23)