5-chloranyl-N2-[2-ethoxy-4-(1-methylpiperidin-4-yl)oxy-phenyl]-N4-(2-propan-2-ylsulfonylphenyl)pyrimidine-2,4-diamine

Systemtic Name: 5-chloranyl-N2-[2-ethoxy-4-(1-methylpiperidin-4-yl)oxy-phenyl]-N4-(2-propan-2-ylsulfonylphenyl)pyrimidine-2,4-diamine Openeye Name: 5-chloro-N2-[2-ethoxy-4-[(1-methyl-4-piperidyl)oxy]phenyl]-N4-(2-isopropylsulfonylphenyl)pyrimidine-2,4-diamine CAS Name: 5-chloro-N2-[2-ethoxy-4-[(1-methyl-4-piperidinyl)oxy]phenyl]-N4-(2-propan-2-ylsulfonylphenyl)pyrimidine-2,4-diamine IUPAC Name: 5-chloro-2-N-[2-ethoxy-4-(1-methylpiperidin-4-yl)oxyphenyl]-4-N-(2-propan-2-ylsulfonylphenyl)pyrimidine-2,4-diamine Traditional Name: [5-chloro-2-[2-ethoxy-4-[(1-methyl-4-piperidyl)oxy]anilino]pyrimidin-4-yl]-(2-isopropylsulfonylphenyl)amine Formula: C27H34ClN5O4S MolecularWeight: 560.10796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)OC2CCN(CC2)C)NC3=NC=C(C(=N3)NC4=CC=CC=C4S(=O)(=O)C(C)C)Cl

Isomeric SMILES

CCOC1=C(C=CC(=C1)OC2CCN(CC2)C)NC3=NC=C(C(=N3)NC4=CC=CC=C4S(=O)(=O)C(C)C)Cl

InChI

InChI=1S/C27H34ClN5O4S/c1-5-36-24-16-20(37-19-12-14-33(4)15-13-19)10-11-22(24)31-27-29-17-21(28)26(32-27)30-23-8-6-7-9-25(23)38(34,35)18(2)3/h6-11,16-19H,5,12-15H2,1-4H3,(H2,29,30,31,32)