N-[4-[(5-bromanyl-4-phenylazanyl-pyrimidin-2-yl)amino]phenyl]-3-chloranyl-propanamide

Systemtic Name: N-[4-[(5-bromanyl-4-phenylazanyl-pyrimidin-2-yl)amino]phenyl]-3-chloranyl-propanamide Openeye Name: N-[4-[(4-anilino-5-bromo-pyrimidin-2-yl)amino]phenyl]-3-chloro-propanamide CAS Name: N-[4-[(4-anilino-5-bromo-2-pyrimidinyl)amino]phenyl]-3-chloropropanamide IUPAC Name: N-[4-[(4-anilino-5-bromopyrimidin-2-yl)amino]phenyl]-3-chloropropanamide Traditional Name: N-[4-[(4-anilino-5-bromo-pyrimidin-2-yl)amino]phenyl]-3-chloro-propionamide Formula: C19H17BrClN5O MolecularWeight: 446.72818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC=C2Br)NC3=CC=C(C=C3)NC(=O)CCCl

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC=C2Br)NC3=CC=C(C=C3)NC(=O)CCCl

InChI

InChI=1S/C19H17BrClN5O/c20-16-12-22-19(26-18(16)24-13-4-2-1-3-5-13)25-15-8-6-14(7-9-15)23-17(27)10-11-21/h1-9,12H,10-11H2,(H,23,27)(H2,22,24,25,26)