N4-(3-methoxyphenyl)-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidine-4,5-diamine

Systemtic Name: N4-(3-methoxyphenyl)-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidine-4,5-diamine Openeye Name: N4-(3-methoxyphenyl)-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidine-4,5-diamine CAS Name: N4-(3-methoxyphenyl)-6-[4-(4-methoxyphenyl)-1-piperazinyl]pyrimidine-4,5-diamine IUPAC Name: 4-N-(3-methoxyphenyl)-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidine-4,5-diamine Traditional Name: [5-amino-6-[4-(4-methoxyphenyl)piperazino]pyrimidin-4-yl]-(3-methoxyphenyl)amine Formula: C22H26N6O2 MolecularWeight: 406.48084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(C(=NC=N3)NC4=CC(=CC=C4)OC)N

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(C(=NC=N3)NC4=CC(=CC=C4)OC)N

InChI

InChI=1S/C22H26N6O2/c1-29-18-8-6-17(7-9-18)27-10-12-28(13-11-27)22-20(23)21(24-15-25-22)26-16-4-3-5-19(14-16)30-2/h3-9,14-15H,10-13,23H2,1-2H3,(H,24,25,26)