N-[5-[6-[(3E)-3-aminocarbonylimino-3-azanyl-propyl]-1H-benzimidazol-2-yl]-1H-pyrrol-2-yl]benzamide

Systemtic Name: N-[5-[6-[(3E)-3-aminocarbonylimino-3-azanyl-propyl]-1H-benzimidazol-2-yl]-1H-pyrrol-2-yl]benzamide Openeye Name: N-[5-[6-[(3E)-3-amino-3-carbamoylimino-propyl]-1H-benzimidazol-2-yl]-1H-pyrrol-2-yl]benzamide CAS Name: N-[5-[6-[(3E)-3-amino-3-carbamoyliminopropyl]-1H-benzimidazol-2-yl]-1H-pyrrol-2-yl]benzamide IUPAC Name: N-[5-[6-[(3E)-3-amino-3-carbamoyliminopropyl]-1H-benzimidazol-2-yl]-1H-pyrrol-2-yl]benzamide Traditional Name: N-[5-[6-[(3E)-3-amino-3-carbamoylimino-propyl]-1H-benzimidazol-2-yl]-1H-pyrrol-2-yl]benzamide Formula: C22H21N7O2 MolecularWeight: 415.44784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC=C(N2)C3=NC4=C(N3)C=C(C=C4)CCC(=NC(=O)N)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC=C(N2)C3=NC4=C(N3)C=C(C=C4)CC/C(=N\C(=O)N)/N

InChI

InChI=1S/C22H21N7O2/c23-18(28-22(24)31)10-7-13-6-8-15-17(12-13)27-20(26-15)16-9-11-19(25-16)29-21(30)14-4-2-1-3-5-14/h1-6,8-9,11-12,25H,7,10H2,(H,26,27)(H,29,30)(H4,23,24,28,31)