5-[2-(4-methoxy-3,5-dimethyl-phenyl)ethyl]-4-piperazin-1-yl-2,6-dipyrrolidin-1-yl-pyrimidine

Systemtic Name: 5-[2-(4-methoxy-3,5-dimethyl-phenyl)ethyl]-4-piperazin-1-yl-2,6-dipyrrolidin-1-yl-pyrimidine Openeye Name: 5-[2-(4-methoxy-3,5-dimethyl-phenyl)ethyl]-4-piperazin-1-yl-2,6-dipyrrolidin-1-yl-pyrimidine CAS Name: 5-[2-(4-methoxy-3,5-dimethylphenyl)ethyl]-4-(1-piperazinyl)-2,6-bis(1-pyrrolidinyl)pyrimidine IUPAC Name: 5-[2-(4-methoxy-3,5-dimethylphenyl)ethyl]-4-piperazin-1-yl-2,6-dipyrrolidin-1-ylpyrimidine Traditional Name: 5-[2-(4-methoxy-3,5-dimethyl-phenyl)ethyl]-4-piperazino-2,6-dipyrrolidino-pyrimidine Formula: C27H40N6O MolecularWeight: 464.6461

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC)C)CCC2=C(N=C(N=C2N3CCNCC3)N4CCCC4)N5CCCC5

Isomeric SMILES

CC1=CC(=CC(=C1OC)C)CCC2=C(N=C(N=C2N3CCNCC3)N4CCCC4)N5CCCC5

InChI

InChI=1S/C27H40N6O/c1-20-18-22(19-21(2)24(20)34-3)8-9-23-25(31-12-4-5-13-31)29-27(33-14-6-7-15-33)30-26(23)32-16-10-28-11-17-32/h18-19,28H,4-17H2,1-3H3