1-[4-[(5-chloranyl-6-ethyl-pyrimidin-4-yl)amino]-2-phenyl-pyrrolidin-1-yl]ethanone

Systemtic Name: 1-[4-[(5-chloranyl-6-ethyl-pyrimidin-4-yl)amino]-2-phenyl-pyrrolidin-1-yl]ethanone Openeye Name: 1-[4-[(5-chloro-6-ethyl-pyrimidin-4-yl)amino]-2-phenyl-pyrrolidin-1-yl]ethanone CAS Name: 1-[4-[(5-chloro-6-ethyl-4-pyrimidinyl)amino]-2-phenyl-1-pyrrolidinyl]ethanone IUPAC Name: 1-[4-[(5-chloro-6-ethylpyrimidin-4-yl)amino]-2-phenylpyrrolidin-1-yl]ethanone Traditional Name: 1-[4-[(5-chloro-6-ethyl-pyrimidin-4-yl)amino]-2-phenyl-pyrrolidino]ethanone Formula: C18H21ClN4O MolecularWeight: 344.83854

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC=N1)NC2CC(N(C2)C(=O)C)C3=CC=CC=C3)Cl

Isomeric SMILES

CCC1=C(C(=NC=N1)NC2CC(N(C2)C(=O)C)C3=CC=CC=C3)Cl

InChI

InChI=1S/C18H21ClN4O/c1-3-15-17(19)18(21-11-20-15)22-14-9-16(23(10-14)12(2)24)13-7-5-4-6-8-13/h4-8,11,14,16H,3,9-10H2,1-2H3,(H,20,21,22)