ethyl 2-(butylamino)-3-[4-(2-methoxyphenyl)piperazin-1-yl]-4,6-dimethyl-4H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-(butylamino)-3-[4-(2-methoxyphenyl)piperazin-1-yl]-4,6-dimethyl-4H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-(butylamino)-3-[4-(2-methoxyphenyl)piperazin-1-yl]-4,6-dimethyl-4H-pyrimidine-5-carboxylate CAS Name: 2-(butylamino)-3-[4-(2-methoxyphenyl)-1-piperazinyl]-4,6-dimethyl-4H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(butylamino)-3-[4-(2-methoxyphenyl)piperazin-1-yl]-4,6-dimethyl-4H-pyrimidine-5-carboxylate Traditional Name: 2-(butylamino)-3-[4-(2-methoxyphenyl)piperazino]-4,6-dimethyl-4H-pyrimidine-5-carboxylic acid ethyl ester Formula: C24H37N5O3 MolecularWeight: 443.58228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC(=C(C(N1N2CCN(CC2)C3=CC=CC=C3OC)C)C(=O)OCC)C

Isomeric SMILES

CCCCNC1=NC(=C(C(N1N2CCN(CC2)C3=CC=CC=C3OC)C)C(=O)OCC)C

InChI

InChI=1S/C24H37N5O3/c1-6-8-13-25-24-26-18(3)22(23(30)32-7-2)19(4)29(24)28-16-14-27(15-17-28)20-11-9-10-12-21(20)31-5/h9-12,19H,6-8,13-17H2,1-5H3,(H,25,26)