1-[[2-[(3-bromophenyl)amino]-4-nitro-phenyl]carbonylamino]thiourea

Systemtic Name: 1-[[2-[(3-bromophenyl)amino]-4-nitro-phenyl]carbonylamino]thiourea Openeye Name: [[2-(3-bromoanilino)-4-nitro-benzoyl]amino]thiourea CAS Name: [[[2-(3-bromoanilino)-4-nitrophenyl]-oxomethyl]amino]thiourea IUPAC Name: [[2-(3-bromoanilino)-4-nitrobenzoyl]amino]thiourea Traditional Name: [[2-(3-bromoanilino)-4-nitro-benzoyl]amino]thiourea Formula: C14H12BrN5O3S MolecularWeight: 410.24578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12BrN5O3S/c15-8-2-1-3-9(6-8)17-12-7-10(20(22)23)4-5-11(12)13(21)18-19-14(16)24/h1-7,17H,(H,18,21)(H3,16,19,24)