4-(4-imidazol-1-ylphenoxy)-5-methyl-2-[4-(3-pyrrolidin-1-ylpropyl)piperazin-1-yl]pyrimidine

Systemtic Name: 4-(4-imidazol-1-ylphenoxy)-5-methyl-2-[4-(3-pyrrolidin-1-ylpropyl)piperazin-1-yl]pyrimidine Openeye Name: 4-(4-imidazol-1-ylphenoxy)-5-methyl-2-[4-(3-pyrrolidin-1-ylpropyl)piperazin-1-yl]pyrimidine CAS Name: 4-[4-(1-imidazolyl)phenoxy]-5-methyl-2-[4-[3-(1-pyrrolidinyl)propyl]-1-piperazinyl]pyrimidine IUPAC Name: 4-(4-imidazol-1-ylphenoxy)-5-methyl-2-[4-(3-pyrrolidin-1-ylpropyl)piperazin-1-yl]pyrimidine Traditional Name: 4-(4-imidazol-1-ylphenoxy)-5-methyl-2-[4-(3-pyrrolidinopropyl)piperazino]pyrimidine Formula: C25H33N7O MolecularWeight: 447.57582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1OC2=CC=C(C=C2)N3C=CN=C3)N4CCN(CC4)CCCN5CCCC5

Isomeric SMILES

CC1=CN=C(N=C1OC2=CC=C(C=C2)N3C=CN=C3)N4CCN(CC4)CCCN5CCCC5

InChI

InChI=1S/C25H33N7O/c1-21-19-27-25(31-17-15-30(16-18-31)13-4-12-29-10-2-3-11-29)28-24(21)33-23-7-5-22(6-8-23)32-14-9-26-20-32/h5-9,14,19-20H,2-4,10-13,15-18H2,1H3