1-(4-nitrophenyl)-3-[[2-(thiophen-2-ylsulfonylamino)phenyl]carbonylamino]thiourea

Systemtic Name: 1-(4-nitrophenyl)-3-[[2-(thiophen-2-ylsulfonylamino)phenyl]carbonylamino]thiourea Openeye Name: 1-(4-nitrophenyl)-3-[[2-(2-thienylsulfonylamino)benzoyl]amino]thiourea CAS Name: 1-(4-nitrophenyl)-3-[[oxo-[2-(thiophen-2-ylsulfonylamino)phenyl]methyl]amino]thiourea IUPAC Name: 1-(4-nitrophenyl)-3-[[2-(thiophen-2-ylsulfonylamino)benzoyl]amino]thiourea Traditional Name: 1-(4-nitrophenyl)-3-[[2-(2-thienylsulfonylamino)benzoyl]amino]thiourea Formula: C18H15N5O5S3 MolecularWeight: 477.5372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H15N5O5S3/c24-17(20-21-18(29)19-12-7-9-13(10-8-12)23(25)26)14-4-1-2-5-15(14)22-31(27,28)16-6-3-11-30-16/h1-11,22H,(H,20,24)(H2,19,21,29)