1-[(5-bromanyl-2-oxidanyl-phenyl)carbonylamino]-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[(5-bromanyl-2-oxidanyl-phenyl)carbonylamino]-3-(4-nitrophenyl)thiourea Openeye Name: 1-[(5-bromo-2-hydroxy-benzoyl)amino]-3-(4-nitrophenyl)thiourea CAS Name: 1-[[(5-bromo-2-hydroxyphenyl)-oxomethyl]amino]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[(5-bromo-2-hydroxybenzoyl)amino]-3-(4-nitrophenyl)thiourea Traditional Name: 1-[(5-bromo-2-hydroxy-benzoyl)amino]-3-(4-nitrophenyl)thiourea Formula: C14H11BrN4O4S MolecularWeight: 411.23054

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NNC(=O)C2=C(C=CC(=C2)Br)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NNC(=O)C2=C(C=CC(=C2)Br)O)[N+](=O)[O-]

InChI

InChI=1S/C14H11BrN4O4S/c15-8-1-6-12(20)11(7-8)13(21)17-18-14(24)16-9-2-4-10(5-3-9)19(22)23/h1-7,20H,(H,17,21)(H2,16,18,24)