1-(4-bromophenyl)-1-[(4-morpholin-4-yl-3-nitro-phenyl)carbonylamino]thiourea

Systemtic Name: 1-(4-bromophenyl)-1-[(4-morpholin-4-yl-3-nitro-phenyl)carbonylamino]thiourea Openeye Name: 1-(4-bromophenyl)-1-[(4-morpholino-3-nitro-benzoyl)amino]thiourea CAS Name: 1-(4-bromophenyl)-1-[[[4-(4-morpholinyl)-3-nitrophenyl]-oxomethyl]amino]thiourea IUPAC Name: 1-(4-bromophenyl)-1-[(4-morpholin-4-yl-3-nitrobenzoyl)amino]thiourea Traditional Name: 1-(4-bromophenyl)-1-[(4-morpholino-3-nitro-benzoyl)amino]thiourea Formula: C18H18BrN5O4S MolecularWeight: 480.33562

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)NN(C3=CC=C(C=C3)Br)C(=S)N)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)NN(C3=CC=C(C=C3)Br)C(=S)N)[N+](=O)[O-]

InChI

InChI=1S/C18H18BrN5O4S/c19-13-2-4-14(5-3-13)23(18(20)29)21-17(25)12-1-6-15(16(11-12)24(26)27)22-7-9-28-10-8-22/h1-6,11H,7-10H2,(H2,20,29)(H,21,25)