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

Systemtic Name: 1-[[2-[(4-methoxyphenyl)sulfamoyl]-4-nitro-phenyl]amino]-3-(4-phenoxyphenyl)thiourea Openeye Name: 1-[2-[(4-methoxyphenyl)sulfamoyl]-4-nitro-anilino]-3-(4-phenoxyphenyl)thiourea CAS Name: 1-[2-[(4-methoxyphenyl)sulfamoyl]-4-nitroanilino]-3-(4-phenoxyphenyl)thiourea IUPAC Name: 1-[2-[(4-methoxyphenyl)sulfamoyl]-4-nitroanilino]-3-(4-phenoxyphenyl)thiourea Traditional Name: 1-[2-[(4-methoxyphenyl)sulfamoyl]-4-nitro-anilino]-3-(4-phenoxyphenyl)thiourea Formula: C26H23N5O6S2 MolecularWeight: 565.62072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NNC(=S)NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NNC(=S)NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C26H23N5O6S2/c1-36-21-12-9-19(10-13-21)30-39(34,35)25-17-20(31(32)33)11-16-24(25)28-29-26(38)27-18-7-14-23(15-8-18)37-22-5-3-2-4-6-22/h2-17,28,30H,1H3,(H2,27,29,38)