[4-[4-(tert-butylamino)pyridazin-3-yl]piperazin-1-yl]-(5-oxidanyl-1H-indol-2-yl)methanone

Systemtic Name: [4-[4-(tert-butylamino)pyridazin-3-yl]piperazin-1-yl]-(5-oxidanyl-1H-indol-2-yl)methanone Openeye Name: [4-[4-(tert-butylamino)pyridazin-3-yl]piperazin-1-yl]-(5-hydroxy-1H-indol-2-yl)methanone CAS Name: [4-[4-(tert-butylamino)-3-pyridazinyl]-1-piperazinyl]-(5-hydroxy-1H-indol-2-yl)methanone IUPAC Name: [4-[4-(tert-butylamino)pyridazin-3-yl]piperazin-1-yl]-(5-hydroxy-1H-indol-2-yl)methanone Traditional Name: [4-[4-(tert-butylamino)pyridazin-3-yl]piperazino]-(5-hydroxy-1H-indol-2-yl)methanone Formula: C21H26N6O2 MolecularWeight: 394.47014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=C(N=NC=C1)N2CCN(CC2)C(=O)C3=CC4=C(N3)C=CC(=C4)O

Isomeric SMILES

CC(C)(C)NC1=C(N=NC=C1)N2CCN(CC2)C(=O)C3=CC4=C(N3)C=CC(=C4)O

InChI

InChI=1S/C21H26N6O2/c1-21(2,3)24-17-6-7-22-25-19(17)26-8-10-27(11-9-26)20(29)18-13-14-12-15(28)4-5-16(14)23-18/h4-7,12-13,23,28H,8-11H2,1-3H3,(H,22,24)