ethyl 2-[[4-[6-ethyl-2-methyl-5-(phenylmethyl)pyrimidin-4-yl]piperazin-1-yl]carbonylamino]ethanoate

Systemtic Name: ethyl 2-[[4-[6-ethyl-2-methyl-5-(phenylmethyl)pyrimidin-4-yl]piperazin-1-yl]carbonylamino]ethanoate Openeye Name: ethyl 2-[[4-(5-benzyl-6-ethyl-2-methyl-pyrimidin-4-yl)piperazine-1-carbonyl]amino]acetate CAS Name: 2-[[[4-[6-ethyl-2-methyl-5-(phenylmethyl)-4-pyrimidinyl]-1-piperazinyl]-oxomethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[4-(5-benzyl-6-ethyl-2-methylpyrimidin-4-yl)piperazine-1-carbonyl]amino]acetate Traditional Name: 2-[[4-(5-benzyl-6-ethyl-2-methyl-pyrimidin-4-yl)piperazine-1-carbonyl]amino]acetic acid ethyl ester Formula: C23H31N5O3 MolecularWeight: 425.52394

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)NCC(=O)OCC)CC3=CC=CC=C3

Isomeric SMILES

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)NCC(=O)OCC)CC3=CC=CC=C3

InChI

InChI=1S/C23H31N5O3/c1-4-20-19(15-18-9-7-6-8-10-18)22(26-17(3)25-20)27-11-13-28(14-12-27)23(30)24-16-21(29)31-5-2/h6-10H,4-5,11-16H2,1-3H3,(H,24,30)