1-ethyl-3-[[4-[(3-nitrophenyl)sulfonylamino]phenyl]carbonylamino]thiourea

Systemtic Name: 1-ethyl-3-[[4-[(3-nitrophenyl)sulfonylamino]phenyl]carbonylamino]thiourea Openeye Name: 1-ethyl-3-[[4-[(3-nitrophenyl)sulfonylamino]benzoyl]amino]thiourea CAS Name: 1-ethyl-3-[[[4-[(3-nitrophenyl)sulfonylamino]phenyl]-oxomethyl]amino]thiourea IUPAC Name: 1-ethyl-3-[[4-[(3-nitrophenyl)sulfonylamino]benzoyl]amino]thiourea Traditional Name: 1-ethyl-3-[[4-[(3-nitrophenyl)sulfonylamino]benzoyl]amino]thiourea Formula: C16H17N5O5S2 MolecularWeight: 423.46668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N5O5S2/c1-2-17-16(27)19-18-15(22)11-6-8-12(9-7-11)20-28(25,26)14-5-3-4-13(10-14)21(23)24/h3-10,20H,2H2,1H3,(H,18,22)(H2,17,19,27)