1-cyclopropyl-3-[(3E)-3-[5-(morpholin-4-ium-4-ylmethyl)benzimidazol-1-ium-2-ylidene]-1,2-dihydropyrazol-4-yl]urea

Systemtic Name: 1-cyclopropyl-3-[(3E)-3-[5-(morpholin-4-ium-4-ylmethyl)benzimidazol-1-ium-2-ylidene]-1,2-dihydropyrazol-4-yl]urea Openeye Name: 1-cyclopropyl-3-[(3E)-3-[5-(morpholin-4-ium-4-ylmethyl)benzimidazol-1-ium-2-ylidene]-1,2-dihydropyrazol-4-yl]urea CAS Name: 1-cyclopropyl-3-[(3E)-3-[5-(4-morpholin-4-iumylmethyl)-2-benzimidazol-1-iumylidene]-1,2-dihydropyrazol-4-yl]urea IUPAC Name: 1-cyclopropyl-3-[(3E)-3-[5-(morpholin-4-ium-4-ylmethyl)benzimidazol-1-ium-2-ylidene]-1,2-dihydropyrazol-4-yl]urea Traditional Name: 1-cyclopropyl-3-[(3E)-3-[5-(morpholin-4-ium-4-ylmethyl)benzimidazol-1-ium-2-ylidene]-3-pyrazolin-4-yl]urea Formula: C19H25N7O2+2 MolecularWeight: 383.4475

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)NC2=CNNC2=C3[NH+]=C4C=CC(=CC4=N3)C[NH+]5CCOCC5

Isomeric SMILES

C1CC1NC(=O)NC\2=CNN/C2=C\3/[NH+]=C4C=CC(=CC4=N3)C[NH+]5CCOCC5

InChI

InChI=1S/C19H23N7O2/c27-19(21-13-2-3-13)24-16-10-20-25-17(16)18-22-14-4-1-12(9-15(14)23-18)11-26-5-7-28-8-6-26/h1,4,9-10,13,20,25H,2-3,5-8,11H2,(H2,21,24,27)/p+2/b18-17-