(1E)-1-[1-azanyl-3-[2-(5-nitrothiophen-3-yl)-3H-benzimidazol-5-yl]propylidene]urea

Systemtic Name: (1E)-1-[1-azanyl-3-[2-(5-nitrothiophen-3-yl)-3H-benzimidazol-5-yl]propylidene]urea Openeye Name: (E)-[1-amino-3-[2-(5-nitro-3-thienyl)-3H-benzimidazol-5-yl]propylidene]urea CAS Name: (E)-[1-amino-3-[2-(5-nitro-3-thiophenyl)-3H-benzimidazol-5-yl]propylidene]urea IUPAC Name: (E)-[1-amino-3-[2-(5-nitrothiophen-3-yl)-3H-benzimidazol-5-yl]propylidene]urea Traditional Name: (E)-[1-amino-3-[2-(5-nitro-3-thienyl)-3H-benzimidazol-5-yl]propylidene]urea Formula: C15H14N6O3S MolecularWeight: 358.37506

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1CCC(=NC(=O)N)N)NC(=N2)C3=CSC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1CC/C(=N\C(=O)N)/N)NC(=N2)C3=CSC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H14N6O3S/c16-12(20-15(17)22)4-2-8-1-3-10-11(5-8)19-14(18-10)9-6-13(21(23)24)25-7-9/h1,3,5-7H,2,4H2,(H,18,19)(H4,16,17,20,22)