5-[[3-fluoranyl-2-(fluoranylmethyl)-8-methoxy-2,4-dimethyl-1H-quinolin-6-yl]methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[[3-fluoranyl-2-(fluoranylmethyl)-8-methoxy-2,4-dimethyl-1H-quinolin-6-yl]methyl]pyrimidine-2,4-diamine Openeye Name: 5-[[3-fluoro-2-(fluoromethyl)-8-methoxy-2,4-dimethyl-1H-quinolin-6-yl]methyl]pyrimidine-2,4-diamine CAS Name: 5-[[3-fluoro-2-(fluoromethyl)-8-methoxy-2,4-dimethyl-1H-quinolin-6-yl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[[3-fluoro-2-(fluoromethyl)-8-methoxy-2,4-dimethyl-1H-quinolin-6-yl]methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[[3-fluoro-2-(fluoromethyl)-8-methoxy-2,4-dimethyl-1H-quinolin-6-yl]methyl]pyrimidin-4-yl]amine Formula: C18H21F2N5O MolecularWeight: 361.389046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC2=C(C=C(C=C12)CC3=CN=C(N=C3N)N)OC)(C)CF)F

Isomeric SMILES

CC1=C(C(NC2=C(C=C(C=C12)CC3=CN=C(N=C3N)N)OC)(C)CF)F

InChI

InChI=1S/C18H21F2N5O/c1-9-12-5-10(4-11-7-23-17(22)24-16(11)21)6-13(26-3)14(12)25-18(2,8-19)15(9)20/h5-7,25H,4,8H2,1-3H3,(H4,21,22,23,24)