(1E)-1-[1-azanyl-3-[(2Z)-2-(5-nitropyrrol-2-ylidene)-1,3-dihydrobenzimidazol-5-yl]propylidene]urea hydrochloride

Systemtic Name: (1E)-1-[1-azanyl-3-[(2Z)-2-(5-nitropyrrol-2-ylidene)-1,3-dihydrobenzimidazol-5-yl]propylidene]urea hydrochloride Openeye Name: (E)-[1-amino-3-[(2Z)-2-(5-nitropyrrol-2-ylidene)-1,3-dihydrobenzimidazol-5-yl]propylidene]urea hydrochloride CAS Name: (E)-[1-amino-3-[(2Z)-2-(5-nitro-2-pyrrolylidene)-1,3-dihydrobenzimidazol-5-yl]propylidene]urea hydrochloride IUPAC Name: (E)-[1-amino-3-[(2Z)-2-(5-nitropyrrol-2-ylidene)-1,3-dihydrobenzimidazol-5-yl]propylidene]urea hydrochloride Traditional Name: (E)-[1-amino-3-[(2Z)-2-(5-nitropyrrol-2-ylidene)-1,3-dihydrobenzimidazol-5-yl]propylidene]urea hydrochloride Formula: C15H16ClN7O3 MolecularWeight: 377.78564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1CCC(=NC(=O)N)N)NC(=C3C=CC(=N3)[N+](=O)[O-])N2.Cl

Isomeric SMILES

C1=CC2=C(C=C1CC/C(=N\C(=O)N)/N)N/C(=C\3/C=CC(=N3)[N+](=O)[O-])/N2.Cl

InChI

InChI=1S/C15H15N7O3.ClH/c16-12(21-15(17)23)5-2-8-1-3-9-11(7-8)20-14(19-9)10-4-6-13(18-10)22(24)25;/h1,3-4,6-7,19-20H,2,5H2,(H4,16,17,21,23);1H/b14-10-;