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

Systemtic Name: furan-2-yl-[4-[5-nitro-6-(2-thiophen-2-ylethylamino)pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: 2-furyl-[4-[5-nitro-6-[2-(2-thienyl)ethylamino]pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: 2-furanyl-[4-[5-nitro-6-(2-thiophen-2-ylethylamino)-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: furan-2-yl-[4-[5-nitro-6-(2-thiophen-2-ylethylamino)pyrimidin-4-yl]piperazin-1-yl]methanone Traditional Name: 2-furyl-[4-[5-nitro-6-[2-(2-thienyl)ethylamino]pyrimidin-4-yl]piperazino]methanone Formula: C19H20N6O4S MolecularWeight: 428.4649

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=NC=N2)NCCC3=CC=CS3)[N+](=O)[O-])C(=O)C4=CC=CO4

Isomeric SMILES

C1CN(CCN1C2=C(C(=NC=N2)NCCC3=CC=CS3)[N+](=O)[O-])C(=O)C4=CC=CO4

InChI

InChI=1S/C19H20N6O4S/c26-19(15-4-1-11-29-15)24-9-7-23(8-10-24)18-16(25(27)28)17(21-13-22-18)20-6-5-14-3-2-12-30-14/h1-4,11-13H,5-10H2,(H,20,21,22)