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

Systemtic Name: 4-(4-oxidanylidene-3H-pyridazino[4,5-b]indol-5-yl)-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-4-(4-oxo-3H-pyridazino[4,5-b]indol-5-yl)butanamide CAS Name: 4-(4-oxo-3H-pyridazino[4,5-b]indol-5-yl)-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-4-(4-oxo-3H-pyridazino[4,5-b]indol-5-yl)butanamide Traditional Name: N-benzyl-4-(4-keto-3H-pyridazin[4,5-b]indol-5-yl)butyramide Formula: C21H20N4O2 MolecularWeight: 360.4091

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CCCN2C3=CC=CC=C3C4=C2C(=O)NN=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CCCN2C3=CC=CC=C3C4=C2C(=O)NN=C4

InChI

InChI=1S/C21H20N4O2/c26-19(22-13-15-7-2-1-3-8-15)11-6-12-25-18-10-5-4-9-16(18)17-14-23-24-21(27)20(17)25/h1-5,7-10,14H,6,11-13H2,(H,22,26)(H,24,27)