tert-butyl 4-[5-ethyl-3-[[4-(2-methoxyphenyl)piperazin-1-yl]carbonylamino]-6-methyl-pyridin-2-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[5-ethyl-3-[[4-(2-methoxyphenyl)piperazin-1-yl]carbonylamino]-6-methyl-pyridin-2-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[5-ethyl-3-[[4-(2-methoxyphenyl)piperazine-1-carbonyl]amino]-6-methyl-2-pyridyl]piperazine-1-carboxylate CAS Name: 4-[5-ethyl-3-[[[4-(2-methoxyphenyl)-1-piperazinyl]-oxomethyl]amino]-6-methyl-2-pyridinyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[5-ethyl-3-[[4-(2-methoxyphenyl)piperazine-1-carbonyl]amino]-6-methylpyridin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[5-ethyl-3-[[4-(2-methoxyphenyl)piperazine-1-carbonyl]amino]-6-methyl-2-pyridyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C29H42N6O4 MolecularWeight: 538.68158

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(N=C1C)N2CCN(CC2)C(=O)OC(C)(C)C)NC(=O)N3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CCC1=CC(=C(N=C1C)N2CCN(CC2)C(=O)OC(C)(C)C)NC(=O)N3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C29H42N6O4/c1-7-22-20-23(26(30-21(22)2)33-14-18-35(19-15-33)28(37)39-29(3,4)5)31-27(36)34-16-12-32(13-17-34)24-10-8-9-11-25(24)38-6/h8-11,20H,7,12-19H2,1-6H3,(H,31,36)