1-(2-bromanyl-4-methyl-phenyl)-3-[(5-methyl-4-oxidanylidene-pyridazino[4,5-b]indol-3-yl)methyl]urea

Systemtic Name: 1-(2-bromanyl-4-methyl-phenyl)-3-[(5-methyl-4-oxidanylidene-pyridazino[4,5-b]indol-3-yl)methyl]urea Openeye Name: 1-(2-bromo-4-methyl-phenyl)-3-[(5-methyl-4-oxo-pyridazino[4,5-b]indol-3-yl)methyl]urea CAS Name: 1-(2-bromo-4-methylphenyl)-3-[(5-methyl-4-oxo-3-pyridazino[4,5-b]indolyl)methyl]urea IUPAC Name: 1-(2-bromo-4-methylphenyl)-3-[(5-methyl-4-oxopyridazino[4,5-b]indol-3-yl)methyl]urea Traditional Name: 1-(2-bromo-4-methyl-phenyl)-3-[(4-keto-5-methyl-pyridazin[4,5-b]indol-3-yl)methyl]urea Formula: C20H18BrN5O2 MolecularWeight: 440.29322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)NCN2C(=O)C3=C(C=N2)C4=CC=CC=C4N3C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)NCN2C(=O)C3=C(C=N2)C4=CC=CC=C4N3C)Br

InChI

InChI=1S/C20H18BrN5O2/c1-12-7-8-16(15(21)9-12)24-20(28)22-11-26-19(27)18-14(10-23-26)13-5-3-4-6-17(13)25(18)2/h3-10H,11H2,1-2H3,(H2,22,24,28)