N-[3-[(3E)-3-[(pyrrol-1-ylamino)methylidene]indazol-6-yl]carbonylphenyl]-1H-indole-4-carboxamide

Systemtic Name: N-[3-[(3E)-3-[(pyrrol-1-ylamino)methylidene]indazol-6-yl]carbonylphenyl]-1H-indole-4-carboxamide Openeye Name: N-[3-[(3E)-3-[(pyrrol-1-ylamino)methylene]indazole-6-carbonyl]phenyl]-1H-indole-4-carboxamide CAS Name: N-[3-[oxo-[(3E)-3-[(1-pyrrolylamino)methylidene]-6-indazolyl]methyl]phenyl]-1H-indole-4-carboxamide IUPAC Name: N-[3-[(3E)-3-[(pyrrol-1-ylamino)methylidene]indazole-6-carbonyl]phenyl]-1H-indole-4-carboxamide Traditional Name: N-[3-[(3E)-3-[(pyrrol-1-ylamino)methylene]indazole-6-carbonyl]phenyl]-1H-indole-4-carboxamide Formula: C28H20N6O2 MolecularWeight: 472.4974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)NC=C2C3=C(C=C(C=C3)C(=O)C4=CC(=CC=C4)NC(=O)C5=C6C=CNC6=CC=C5)N=N2

Isomeric SMILES

C1=CN(C=C1)N/C=C/2\C3=C(C=C(C=C3)C(=O)C4=CC(=CC=C4)NC(=O)C5=C6C=CNC6=CC=C5)N=N2

InChI

InChI=1S/C28H20N6O2/c35-27(19-9-10-23-25(16-19)32-33-26(23)17-30-34-13-1-2-14-34)18-5-3-6-20(15-18)31-28(36)22-7-4-8-24-21(22)11-12-29-24/h1-17,29-30H,(H,31,36)/b26-17+