N2-(2-chloroethyloxymethyl)-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine-2,4-diamine

Systemtic Name: N2-(2-chloroethyloxymethyl)-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine-2,4-diamine Openeye Name: N2-(2-chloroethoxymethyl)-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine-2,4-diamine CAS Name: N2-(2-chloroethoxymethyl)-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine-2,4-diamine IUPAC Name: 2-N-(2-chloroethoxymethyl)-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine-2,4-diamine Traditional Name: [4-amino-5-(3,4,5-trimethoxybenzyl)pyrimidin-2-yl]-(2-chloroethoxymethyl)amine Formula: C17H23ClN4O4 MolecularWeight: 382.84192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC2=CN=C(N=C2N)NCOCCCl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC2=CN=C(N=C2N)NCOCCCl

InChI

InChI=1S/C17H23ClN4O4/c1-23-13-7-11(8-14(24-2)15(13)25-3)6-12-9-20-17(22-16(12)19)21-10-26-5-4-18/h7-9H,4-6,10H2,1-3H3,(H3,19,20,21,22)