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

Systemtic Name: tert-butyl 4-[3-[[4-(3,5-dimethylphenyl)piperazin-1-yl]carbonylamino]-5-ethyl-6-methyl-pyridin-2-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-[[4-(3,5-dimethylphenyl)piperazine-1-carbonyl]amino]-5-ethyl-6-methyl-2-pyridyl]piperazine-1-carboxylate CAS Name: 4-[3-[[[4-(3,5-dimethylphenyl)-1-piperazinyl]-oxomethyl]amino]-5-ethyl-6-methyl-2-pyridinyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-[[4-(3,5-dimethylphenyl)piperazine-1-carbonyl]amino]-5-ethyl-6-methylpyridin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[3-[[4-(3,5-dimethylphenyl)piperazine-1-carbonyl]amino]-5-ethyl-6-methyl-2-pyridyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C30H44N6O3 MolecularWeight: 536.70876

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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(=C4)C)C

Isomeric SMILES

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

InChI

InChI=1S/C30H44N6O3/c1-8-24-20-26(27(31-23(24)4)34-11-15-36(16-12-34)29(38)39-30(5,6)7)32-28(37)35-13-9-33(10-14-35)25-18-21(2)17-22(3)19-25/h17-20H,8-16H2,1-7H3,(H,32,37)