ethyl 2-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butylamino]-4,6-dimethyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butylamino]-4,6-dimethyl-pyrimidine-5-carboxylate Openeye Name: ethyl 2-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butylamino]-4,6-dimethyl-pyrimidine-5-carboxylate CAS Name: 2-[4-[4-(2-methoxyphenyl)-1-piperazinyl]butylamino]-4,6-dimethyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butylamino]-4,6-dimethylpyrimidine-5-carboxylate Traditional Name: 2-[4-[4-(2-methoxyphenyl)piperazino]butylamino]-4,6-dimethyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C24H35N5O3 MolecularWeight: 441.5664

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=C1C)NCCCCN2CCN(CC2)C3=CC=CC=C3OC)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1C)NCCCCN2CCN(CC2)C3=CC=CC=C3OC)C

InChI

InChI=1S/C24H35N5O3/c1-5-32-23(30)22-18(2)26-24(27-19(22)3)25-12-8-9-13-28-14-16-29(17-15-28)20-10-6-7-11-21(20)31-4/h6-7,10-11H,5,8-9,12-17H2,1-4H3,(H,25,26,27)