1-[[5-[(2-azanyl-6-chloranyl-pyrimidin-4-yl)amino]-2-methyl-phenyl]methyl]pyrrolidin-2-one

Systemtic Name: 1-[[5-[(2-azanyl-6-chloranyl-pyrimidin-4-yl)amino]-2-methyl-phenyl]methyl]pyrrolidin-2-one Openeye Name: 1-[[5-[(2-amino-6-chloro-pyrimidin-4-yl)amino]-2-methyl-phenyl]methyl]pyrrolidin-2-one CAS Name: 1-[[5-[(2-amino-6-chloro-4-pyrimidinyl)amino]-2-methylphenyl]methyl]-2-pyrrolidinone IUPAC Name: 1-[[5-[(2-amino-6-chloropyrimidin-4-yl)amino]-2-methylphenyl]methyl]pyrrolidin-2-one Traditional Name: 1-[5-[(2-amino-6-chloro-pyrimidin-4-yl)amino]-2-methyl-benzyl]-2-pyrrolidone Formula: C16H18ClN5O MolecularWeight: 331.80002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=CC(=NC(=N2)N)Cl)CN3CCCC3=O

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=CC(=NC(=N2)N)Cl)CN3CCCC3=O

InChI

InChI=1S/C16H18ClN5O/c1-10-4-5-12(19-14-8-13(17)20-16(18)21-14)7-11(10)9-22-6-2-3-15(22)23/h4-5,7-8H,2-3,6,9H2,1H3,(H3,18,19,20,21)