1-(3,5-dimethylphenyl)-3-[[4-[(2-methoxyphenyl)sulfamoyl]-2-nitro-phenyl]amino]thiourea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-[[4-[(2-methoxyphenyl)sulfamoyl]-2-nitro-phenyl]amino]thiourea Openeye Name: 1-(3,5-dimethylphenyl)-3-[4-[(2-methoxyphenyl)sulfamoyl]-2-nitro-anilino]thiourea CAS Name: 1-(3,5-dimethylphenyl)-3-[4-[(2-methoxyphenyl)sulfamoyl]-2-nitroanilino]thiourea IUPAC Name: 1-(3,5-dimethylphenyl)-3-[4-[(2-methoxyphenyl)sulfamoyl]-2-nitroanilino]thiourea Traditional Name: 1-(3,5-dimethylphenyl)-3-[4-[(2-methoxyphenyl)sulfamoyl]-2-nitro-anilino]thiourea Formula: C22H23N5O5S2 MolecularWeight: 501.57852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)NNC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3OC)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)NNC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3OC)[N+](=O)[O-])C

InChI

InChI=1S/C22H23N5O5S2/c1-14-10-15(2)12-16(11-14)23-22(33)25-24-18-9-8-17(13-20(18)27(28)29)34(30,31)26-19-6-4-5-7-21(19)32-3/h4-13,24,26H,1-3H3,(H2,23,25,33)