N-[(4-chlorophenyl)methyl]-4-(4-oxidanylidene-3H-pyridazino[4,5-b]indol-5-yl)butanamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-4-(4-oxidanylidene-3H-pyridazino[4,5-b]indol-5-yl)butanamide Openeye Name: N-[(4-chlorophenyl)methyl]-4-(4-oxo-3H-pyridazino[4,5-b]indol-5-yl)butanamide CAS Name: N-[(4-chlorophenyl)methyl]-4-(4-oxo-3H-pyridazino[4,5-b]indol-5-yl)butanamide IUPAC Name: N-[(4-chlorophenyl)methyl]-4-(4-oxo-3H-pyridazino[4,5-b]indol-5-yl)butanamide Traditional Name: N-(4-chlorobenzyl)-4-(4-keto-3H-pyridazin[4,5-b]indol-5-yl)butyramide Formula: C21H19ClN4O2 MolecularWeight: 394.85416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(N2CCCC(=O)NCC4=CC=C(C=C4)Cl)C(=O)NN=C3

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(N2CCCC(=O)NCC4=CC=C(C=C4)Cl)C(=O)NN=C3

InChI

InChI=1S/C21H19ClN4O2/c22-15-9-7-14(8-10-15)12-23-19(27)6-3-11-26-18-5-2-1-4-16(18)17-13-24-25-21(28)20(17)26/h1-2,4-5,7-10,13H,3,6,11-12H2,(H,23,27)(H,25,28)