6-chloranyl-5-[1-(3,4,5-trimethoxyphenyl)piperidin-4-yl]pyrimidine-2,4-diamine

Systemtic Name: 6-chloranyl-5-[1-(3,4,5-trimethoxyphenyl)piperidin-4-yl]pyrimidine-2,4-diamine Openeye Name: 6-chloro-5-[1-(3,4,5-trimethoxyphenyl)-4-piperidyl]pyrimidine-2,4-diamine CAS Name: 6-chloro-5-[1-(3,4,5-trimethoxyphenyl)-4-piperidinyl]pyrimidine-2,4-diamine IUPAC Name: 6-chloro-5-[1-(3,4,5-trimethoxyphenyl)piperidin-4-yl]pyrimidine-2,4-diamine Traditional Name: [2-amino-6-chloro-5-[1-(3,4,5-trimethoxyphenyl)-4-piperidyl]pyrimidin-4-yl]amine Formula: C18H24ClN5O3 MolecularWeight: 393.86786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)N2CCC(CC2)C3=C(N=C(N=C3Cl)N)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)N2CCC(CC2)C3=C(N=C(N=C3Cl)N)N

InChI

InChI=1S/C18H24ClN5O3/c1-25-12-8-11(9-13(26-2)15(12)27-3)24-6-4-10(5-7-24)14-16(19)22-18(21)23-17(14)20/h8-10H,4-7H2,1-3H3,(H4,20,21,22,23)