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

Systemtic Name: 1-[[4-[(2,4-dimethylphenyl)sulfamoyl]-2-nitro-phenyl]amino]-3-(4-methylphenyl)thiourea Openeye Name: 1-[4-[(2,4-dimethylphenyl)sulfamoyl]-2-nitro-anilino]-3-(p-tolyl)thiourea CAS Name: 1-[4-[(2,4-dimethylphenyl)sulfamoyl]-2-nitroanilino]-3-(4-methylphenyl)thiourea IUPAC Name: 1-[4-[(2,4-dimethylphenyl)sulfamoyl]-2-nitroanilino]-3-(4-methylphenyl)thiourea Traditional Name: 1-[4-[(2,4-dimethylphenyl)sulfamoyl]-2-nitro-anilino]-3-(p-tolyl)thiourea Formula: C22H23N5O4S2 MolecularWeight: 485.57912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NNC2=C(C=C(C=C2)S(=O)(=O)NC3=C(C=C(C=C3)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NNC2=C(C=C(C=C2)S(=O)(=O)NC3=C(C=C(C=C3)C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H23N5O4S2/c1-14-4-7-17(8-5-14)23-22(32)25-24-20-11-9-18(13-21(20)27(28)29)33(30,31)26-19-10-6-15(2)12-16(19)3/h4-13,24,26H,1-3H3,(H2,23,25,32)