1-[[4-[(4-methyl-3-nitro-phenyl)sulfonylamino]phenyl]carbonylamino]-3-(2-methylphenyl)thiourea

Systemtic Name: 1-[[4-[(4-methyl-3-nitro-phenyl)sulfonylamino]phenyl]carbonylamino]-3-(2-methylphenyl)thiourea Openeye Name: 1-[[4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzoyl]amino]-3-(o-tolyl)thiourea CAS Name: 1-[[[4-[(4-methyl-3-nitrophenyl)sulfonylamino]phenyl]-oxomethyl]amino]-3-(2-methylphenyl)thiourea IUPAC Name: 1-[[4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzoyl]amino]-3-(2-methylphenyl)thiourea Traditional Name: 1-[[4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzoyl]amino]-3-(o-tolyl)thiourea Formula: C22H21N5O5S2 MolecularWeight: 499.56264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC3=CC=CC=C3C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC3=CC=CC=C3C)[N+](=O)[O-]

InChI

InChI=1S/C22H21N5O5S2/c1-14-5-3-4-6-19(14)23-22(33)25-24-21(28)16-8-10-17(11-9-16)26-34(31,32)18-12-7-15(2)20(13-18)27(29)30/h3-13,26H,1-2H3,(H,24,28)(H2,23,25,33)