N-(2,5-dimethylpyrrol-1-yl)-8-phenylmethoxy-5H-pyridazino[4,5-b]indol-4-amine

Systemtic Name: N-(2,5-dimethylpyrrol-1-yl)-8-phenylmethoxy-5H-pyridazino[4,5-b]indol-4-amine Openeye Name: 8-benzyloxy-N-(2,5-dimethylpyrrol-1-yl)-5H-pyridazino[4,5-b]indol-4-amine CAS Name: N-(2,5-dimethyl-1-pyrrolyl)-8-phenylmethoxy-5H-pyridazino[4,5-b]indol-4-amine IUPAC Name: N-(2,5-dimethylpyrrol-1-yl)-8-phenylmethoxy-5H-pyridazino[4,5-b]indol-4-amine Traditional Name: (8-benzoxy-5H-pyridazin[4,5-b]indol-4-yl)-(2,5-dimethylpyrrol-1-yl)amine Formula: C23H21N5O MolecularWeight: 383.44574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1NC2=C3C(=CN=N2)C4=C(N3)C=CC(=C4)OCC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC=C(N1NC2=C3C(=CN=N2)C4=C(N3)C=CC(=C4)OCC5=CC=CC=C5)C

InChI

InChI=1S/C23H21N5O/c1-15-8-9-16(2)28(15)27-23-22-20(13-24-26-23)19-12-18(10-11-21(19)25-22)29-14-17-6-4-3-5-7-17/h3-13,25H,14H2,1-2H3,(H,26,27)