7-chloranyl-5-methyl-3-phenyl-1-(4-propylpiperazin-1-yl)carbonyl-pyridazino[4,5-b]indol-4-one

Systemtic Name: 7-chloranyl-5-methyl-3-phenyl-1-(4-propylpiperazin-1-yl)carbonyl-pyridazino[4,5-b]indol-4-one Openeye Name: 7-chloro-5-methyl-3-phenyl-1-(4-propylpiperazine-1-carbonyl)pyridazino[4,5-b]indol-4-one CAS Name: 7-chloro-5-methyl-1-[oxo-(4-propyl-1-piperazinyl)methyl]-3-phenyl-4-pyridazino[4,5-b]indolone IUPAC Name: 7-chloro-5-methyl-3-phenyl-1-(4-propylpiperazine-1-carbonyl)pyridazino[4,5-b]indol-4-one Traditional Name: 7-chloro-5-methyl-3-phenyl-1-(4-propylpiperazine-1-carbonyl)pyridazin[4,5-b]indol-4-one Formula: C25H26ClN5O2 MolecularWeight: 463.95924

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C(=O)C2=NN(C(=O)C3=C2C4=C(N3C)C=C(C=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

CCCN1CCN(CC1)C(=O)C2=NN(C(=O)C3=C2C4=C(N3C)C=C(C=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C25H26ClN5O2/c1-3-11-29-12-14-30(15-13-29)24(32)22-21-19-10-9-17(26)16-20(19)28(2)23(21)25(33)31(27-22)18-7-5-4-6-8-18/h4-10,16H,3,11-15H2,1-2H3