5-[3-[4-[3,4-bis(chloranyl)phenoxy]piperidin-1-yl]propyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[3-[4-[3,4-bis(chloranyl)phenoxy]piperidin-1-yl]propyl]pyrimidine-2,4-diamine Openeye Name: 5-[3-[4-(3,4-dichlorophenoxy)-1-piperidyl]propyl]pyrimidine-2,4-diamine CAS Name: 5-[3-[4-(3,4-dichlorophenoxy)-1-piperidinyl]propyl]pyrimidine-2,4-diamine IUPAC Name: 5-[3-[4-(3,4-dichlorophenoxy)piperidin-1-yl]propyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[3-[4-(3,4-dichlorophenoxy)piperidino]propyl]pyrimidin-4-yl]amine Formula: C18H23Cl2N5O MolecularWeight: 396.31412

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=CC(=C(C=C2)Cl)Cl)CCCC3=CN=C(N=C3N)N

Isomeric SMILES

C1CN(CCC1OC2=CC(=C(C=C2)Cl)Cl)CCCC3=CN=C(N=C3N)N

InChI

InChI=1S/C18H23Cl2N5O/c19-15-4-3-14(10-16(15)20)26-13-5-8-25(9-6-13)7-1-2-12-11-23-18(22)24-17(12)21/h3-4,10-11,13H,1-2,5-9H2,(H4,21,22,23,24)