[1-(5-nitroindol-1-yl)-3-(propan-2-ylamino)-4-pyridin-2-yl-piperazin-2-ylidene]methanone

Systemtic Name: [1-(5-nitroindol-1-yl)-3-(propan-2-ylamino)-4-pyridin-2-yl-piperazin-2-ylidene]methanone Openeye Name: [3-(isopropylamino)-1-(5-nitroindol-1-yl)-4-(2-pyridyl)piperazin-2-ylidene]methanone CAS Name: [1-(5-nitro-1-indolyl)-3-(propan-2-ylamino)-4-(2-pyridinyl)-2-piperazinylidene]methanone IUPAC Name: [1-(5-nitroindol-1-yl)-3-(propan-2-ylamino)-4-pyridin-2-ylpiperazin-2-ylidene]methanone Traditional Name: [3-(isopropylamino)-1-(5-nitroindol-1-yl)-4-(2-pyridyl)piperazin-2-ylidene]methanone Formula: C21H22N6O3 MolecularWeight: 406.43778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1C(=C=O)N(CCN1C2=CC=CC=N2)N3C=CC4=C3C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC1C(=C=O)N(CCN1C2=CC=CC=N2)N3C=CC4=C3C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H22N6O3/c1-15(2)23-21-19(14-28)26(12-11-24(21)20-5-3-4-9-22-20)25-10-8-16-13-17(27(29)30)6-7-18(16)25/h3-10,13,15,21,23H,11-12H2,1-2H3