2-[4-[3-(aminomethyl)pyrrol-1-yl]phenyl]-1H-benzimidazole-4-carboxamide

Systemtic Name: 2-[4-[3-(aminomethyl)pyrrol-1-yl]phenyl]-1H-benzimidazole-4-carboxamide Openeye Name: 2-[4-[3-(aminomethyl)pyrrol-1-yl]phenyl]-1H-benzimidazole-4-carboxamide CAS Name: 2-[4-[3-(aminomethyl)-1-pyrrolyl]phenyl]-1H-benzimidazole-4-carboxamide IUPAC Name: 2-[4-[3-(aminomethyl)pyrrol-1-yl]phenyl]-1H-benzimidazole-4-carboxamide Traditional Name: 2-[4-[3-(aminomethyl)pyrrol-1-yl]phenyl]-1H-benzimidazole-4-carboxamide Formula: C19H17N5O MolecularWeight: 331.37118

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)NC(=N2)C3=CC=C(C=C3)N4C=CC(=C4)CN)C(=O)N

Isomeric SMILES

C1=CC(=C2C(=C1)NC(=N2)C3=CC=C(C=C3)N4C=CC(=C4)CN)C(=O)N

InChI

InChI=1S/C19H17N5O/c20-10-12-8-9-24(11-12)14-6-4-13(5-7-14)19-22-16-3-1-2-15(18(21)25)17(16)23-19/h1-9,11H,10,20H2,(H2,21,25)(H,22,23)