1-[2-[(4-nitro-1H-imidazol-5-yl)amino]ethyl]-3-phenyl-thiourea

Systemtic Name: 1-[2-[(4-nitro-1H-imidazol-5-yl)amino]ethyl]-3-phenyl-thiourea Openeye Name: 1-[2-[(4-nitro-1H-imidazol-5-yl)amino]ethyl]-3-phenyl-thiourea CAS Name: 1-[2-[(4-nitro-1H-imidazol-5-yl)amino]ethyl]-3-phenylthiourea IUPAC Name: 1-[2-[(4-nitro-1H-imidazol-5-yl)amino]ethyl]-3-phenylthiourea Traditional Name: 1-[2-[(4-nitro-1H-imidazol-5-yl)amino]ethyl]-3-phenyl-thiourea Formula: C12H14N6O2S MolecularWeight: 306.34356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NCCNC2=C(N=CN2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NCCNC2=C(N=CN2)[N+](=O)[O-]

InChI

InChI=1S/C12H14N6O2S/c19-18(20)11-10(15-8-16-11)13-6-7-14-12(21)17-9-4-2-1-3-5-9/h1-5,8,13H,6-7H2,(H,15,16)(H2,14,17,21)