N-[3-[(2-azanyl-3H-benzimidazol-5-yl)amino]-2-oxidanyl-3-oxidanylidene-1-phenyl-propyl]-4-pyrrol-1-yl-benzamide

Systemtic Name: N-[3-[(2-azanyl-3H-benzimidazol-5-yl)amino]-2-oxidanyl-3-oxidanylidene-1-phenyl-propyl]-4-pyrrol-1-yl-benzamide Openeye Name: N-[3-[(2-amino-3H-benzimidazol-5-yl)amino]-2-hydroxy-3-oxo-1-phenyl-propyl]-4-pyrrol-1-yl-benzamide CAS Name: N-[3-[(2-amino-3H-benzimidazol-5-yl)amino]-2-hydroxy-3-oxo-1-phenylpropyl]-4-(1-pyrrolyl)benzamide IUPAC Name: N-[3-[(2-amino-3H-benzimidazol-5-yl)amino]-2-hydroxy-3-oxo-1-phenylpropyl]-4-pyrrol-1-ylbenzamide Traditional Name: N-[3-[(2-amino-3H-benzimidazol-5-yl)amino]-2-hydroxy-3-keto-1-phenyl-propyl]-4-pyrrol-1-yl-benzamide Formula: C27H24N6O3 MolecularWeight: 480.51786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(C(=O)NC2=CC3=C(C=C2)N=C(N3)N)O)NC(=O)C4=CC=C(C=C4)N5C=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(C(C(=O)NC2=CC3=C(C=C2)N=C(N3)N)O)NC(=O)C4=CC=C(C=C4)N5C=CC=C5

InChI

InChI=1S/C27H24N6O3/c28-27-30-21-13-10-19(16-22(21)31-27)29-26(36)24(34)23(17-6-2-1-3-7-17)32-25(35)18-8-11-20(12-9-18)33-14-4-5-15-33/h1-16,23-24,34H,(H,29,36)(H,32,35)(H3,28,30,31)