sodium 4-[1-[(4-chloranyl-5-ethyl-4H-pyrimidin-3-yl)amino]-2-methyl-propyl]phenol

Systemtic Name: sodium 4-[1-[(4-chloranyl-5-ethyl-4H-pyrimidin-3-yl)amino]-2-methyl-propyl]phenol Openeye Name: sodium 4-[1-[(4-chloro-5-ethyl-4H-pyrimidin-3-yl)amino]-2-methyl-propyl]phenol CAS Name: sodium 4-[1-[(4-chloro-5-ethyl-4H-pyrimidin-3-yl)amino]-2-methylpropyl]phenol IUPAC Name: sodium 4-[1-[(4-chloro-5-ethyl-4H-pyrimidin-3-yl)amino]-2-methylpropyl]phenol Traditional Name: sodium 4-[1-[(4-chloro-5-ethyl-4H-pyrimidin-3-yl)amino]-2-methyl-propyl]phenol Formula: C16H22ClN3NaO+ MolecularWeight: 330.80815

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=CN(C1Cl)NC(C2=CC=C(C=C2)O)C(C)C.[Na+]

Isomeric SMILES

CCC1=CN=CN(C1Cl)NC(C2=CC=C(C=C2)O)C(C)C.[Na+]

InChI

InChI=1S/C16H22ClN3O.Na/c1-4-12-9-18-10-20(16(12)17)19-15(11(2)3)13-5-7-14(21)8-6-13;/h5-11,15-16,19,21H,4H2,1-3H3;/q;+1