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

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[(2-nitro-4-sulfamoyl-phenyl)amino]thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-(2-nitro-4-sulfamoyl-anilino)thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-(2-nitro-4-sulfamoylanilino)thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-(2-nitro-4-sulfamoylanilino)thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-(2-nitro-4-sulfamoyl-anilino)thiourea Formula: C14H14ClN5O4S2 MolecularWeight: 415.87506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C14H14ClN5O4S2/c1-8-10(15)3-2-4-11(8)17-14(25)19-18-12-6-5-9(26(16,23)24)7-13(12)20(21)22/h2-7,18H,1H3,(H2,16,23,24)(H2,17,19,25)