[4-[3-(2-methylbutan-2-ylamino)pyridin-2-yl]piperazin-1-yl]-(5-nitro-1H-indol-2-yl)methanone

Systemtic Name: [4-[3-(2-methylbutan-2-ylamino)pyridin-2-yl]piperazin-1-yl]-(5-nitro-1H-indol-2-yl)methanone Openeye Name: [4-[3-(1,1-dimethylpropylamino)-2-pyridyl]piperazin-1-yl]-(5-nitro-1H-indol-2-yl)methanone CAS Name: [4-[3-(2-methylbutan-2-ylamino)-2-pyridinyl]-1-piperazinyl]-(5-nitro-1H-indol-2-yl)methanone IUPAC Name: [4-[3-(2-methylbutan-2-ylamino)pyridin-2-yl]piperazin-1-yl]-(5-nitro-1H-indol-2-yl)methanone Traditional Name: [4-[3-(tert-amylamino)-2-pyridyl]piperazino]-(5-nitro-1H-indol-2-yl)methanone Formula: C23H28N6O3 MolecularWeight: 436.50682

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC1=C(N=CC=C1)N2CCN(CC2)C(=O)C3=CC4=C(N3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CCC(C)(C)NC1=C(N=CC=C1)N2CCN(CC2)C(=O)C3=CC4=C(N3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H28N6O3/c1-4-23(2,3)26-19-6-5-9-24-21(19)27-10-12-28(13-11-27)22(30)20-15-16-14-17(29(31)32)7-8-18(16)25-20/h5-9,14-15,25-26H,4,10-13H2,1-3H3