[2-[[4-chloranyl-3-(3-methylbut-2-enoxy)phenyl]amino]pyrimidin-4-yl]methanol

Systemtic Name: [2-[[4-chloranyl-3-(3-methylbut-2-enoxy)phenyl]amino]pyrimidin-4-yl]methanol Openeye Name: [2-[4-chloro-3-(3-methylbut-2-enoxy)anilino]pyrimidin-4-yl]methanol CAS Name: [2-[4-chloro-3-(3-methylbut-2-enoxy)anilino]-4-pyrimidinyl]methanol IUPAC Name: [2-[4-chloro-3-(3-methylbut-2-enoxy)anilino]pyrimidin-4-yl]methanol Traditional Name: [2-[4-chloro-3-(3-methylbut-2-enoxy)anilino]pyrimidin-4-yl]methanol Formula: C16H18ClN3O2 MolecularWeight: 319.78602

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC1=C(C=CC(=C1)NC2=NC=CC(=N2)CO)Cl)C

Isomeric SMILES

CC(=CCOC1=C(C=CC(=C1)NC2=NC=CC(=N2)CO)Cl)C

InChI

InChI=1S/C16H18ClN3O2/c1-11(2)6-8-22-15-9-12(3-4-14(15)17)19-16-18-7-5-13(10-21)20-16/h3-7,9,21H,8,10H2,1-2H3,(H,18,19,20)