[4-[6-[(diphenylmethyl)amino]-5-nitro-pyrimidin-4-yl]piperazin-1-yl]-(furan-2-yl)methanone

Systemtic Name: [4-[6-[(diphenylmethyl)amino]-5-nitro-pyrimidin-4-yl]piperazin-1-yl]-(furan-2-yl)methanone Openeye Name: [4-[6-(benzhydrylamino)-5-nitro-pyrimidin-4-yl]piperazin-1-yl]-(2-furyl)methanone CAS Name: [4-[6-[(diphenylmethyl)amino]-5-nitro-4-pyrimidinyl]-1-piperazinyl]-(2-furanyl)methanone IUPAC Name: [4-[6-(benzhydrylamino)-5-nitropyrimidin-4-yl]piperazin-1-yl]-(furan-2-yl)methanone Traditional Name: [4-[6-(benzhydrylamino)-5-nitro-pyrimidin-4-yl]piperazino]-(2-furyl)methanone Formula: C26H24N6O4 MolecularWeight: 484.50656

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=NC=N2)NC(C3=CC=CC=C3)C4=CC=CC=C4)[N+](=O)[O-])C(=O)C5=CC=CO5

Isomeric SMILES

C1CN(CCN1C2=C(C(=NC=N2)NC(C3=CC=CC=C3)C4=CC=CC=C4)[N+](=O)[O-])C(=O)C5=CC=CO5

InChI

InChI=1S/C26H24N6O4/c33-26(21-12-7-17-36-21)31-15-13-30(14-16-31)25-23(32(34)35)24(27-18-28-25)29-22(19-8-3-1-4-9-19)20-10-5-2-6-11-20/h1-12,17-18,22H,13-16H2,(H,27,28,29)