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

Systemtic Name: [1-(5-bromanylindol-1-yl)-3-(propan-2-ylamino)-4-pyridin-2-yl-piperazin-2-ylidene]methanone Openeye Name: [1-(5-bromoindol-1-yl)-3-(isopropylamino)-4-(2-pyridyl)piperazin-2-ylidene]methanone CAS Name: [1-(5-bromo-1-indolyl)-3-(propan-2-ylamino)-4-(2-pyridinyl)-2-piperazinylidene]methanone IUPAC Name: [1-(5-bromoindol-1-yl)-3-(propan-2-ylamino)-4-pyridin-2-ylpiperazin-2-ylidene]methanone Traditional Name: [1-(5-bromoindol-1-yl)-3-(isopropylamino)-4-(2-pyridyl)piperazin-2-ylidene]methanone Formula: C21H22BrN5O MolecularWeight: 440.33628

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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)Br

Isomeric SMILES

CC(C)NC1C(=C=O)N(CCN1C2=CC=CC=N2)N3C=CC4=C3C=CC(=C4)Br

InChI

InChI=1S/C21H22BrN5O/c1-15(2)24-21-19(14-28)27(12-11-25(21)20-5-3-4-9-23-20)26-10-8-16-13-17(22)6-7-18(16)26/h3-10,13,15,21,24H,11-12H2,1-2H3