N-[4-[2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidin-4-yl]phenyl]-2-thiophen-2-yl-ethanamide

Systemtic Name: N-[4-[2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidin-4-yl]phenyl]-2-thiophen-2-yl-ethanamide Openeye Name: N-[4-[2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]pyrimidin-4-yl]phenyl]-2-(2-thienyl)acetamide CAS Name: N-[4-[2-[2-[(5-nitro-2-pyridinyl)amino]ethylamino]-4-pyrimidinyl]phenyl]-2-thiophen-2-ylacetamide IUPAC Name: N-[4-[2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidin-4-yl]phenyl]-2-thiophen-2-ylacetamide Traditional Name: N-[4-[2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]pyrimidin-4-yl]phenyl]-2-(2-thienyl)acetamide Formula: C23H21N7O3S MolecularWeight: 475.52294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CC(=O)NC2=CC=C(C=C2)C3=NC(=NC=C3)NCCNC4=NC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)CC(=O)NC2=CC=C(C=C2)C3=NC(=NC=C3)NCCNC4=NC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H21N7O3S/c31-22(14-19-2-1-13-34-19)28-17-5-3-16(4-6-17)20-9-10-25-23(29-20)26-12-11-24-21-8-7-18(15-27-21)30(32)33/h1-10,13,15H,11-12,14H2,(H,24,27)(H,28,31)(H,25,26,29)