N-[4-[2-azanyl-6-(3-nitrophenyl)pyrimidin-4-yl]phenyl]-7-chloranyl-quinolin-4-amine

Systemtic Name: N-[4-[2-azanyl-6-(3-nitrophenyl)pyrimidin-4-yl]phenyl]-7-chloranyl-quinolin-4-amine Openeye Name: N-[4-[2-amino-6-(3-nitrophenyl)pyrimidin-4-yl]phenyl]-7-chloro-quinolin-4-amine CAS Name: N-[4-[2-amino-6-(3-nitrophenyl)-4-pyrimidinyl]phenyl]-7-chloro-4-quinolinamine IUPAC Name: N-[4-[2-amino-6-(3-nitrophenyl)pyrimidin-4-yl]phenyl]-7-chloroquinolin-4-amine Traditional Name: [4-[2-amino-6-(3-nitrophenyl)pyrimidin-4-yl]phenyl]-(7-chloro-4-quinolyl)amine Formula: C25H17ClN6O2 MolecularWeight: 468.89448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=NC(=NC(=C2)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)Cl)N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=NC(=NC(=C2)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)Cl)N

InChI

InChI=1S/C25H17ClN6O2/c26-17-6-9-20-21(10-11-28-24(20)13-17)29-18-7-4-15(5-8-18)22-14-23(31-25(27)30-22)16-2-1-3-19(12-16)32(33)34/h1-14H,(H,28,29)(H2,27,30,31)