[5-tert-butyl-3-[[4-[2-[(4-ethanoylpiperazin-1-yl)methyl]pyridin-4-yl]oxynaphthalen-1-yl]carbamoylamino]-2-methoxy-phenyl]carbamic acid

Systemtic Name: [5-tert-butyl-3-[[4-[2-[(4-ethanoylpiperazin-1-yl)methyl]pyridin-4-yl]oxynaphthalen-1-yl]carbamoylamino]-2-methoxy-phenyl]carbamic acid Openeye Name: [3-[[4-[[2-[(4-acetylpiperazin-1-yl)methyl]-4-pyridyl]oxy]-1-naphthyl]carbamoylamino]-5-tert-butyl-2-methoxy-phenyl]carbamic acid CAS Name: [3-[[[[4-[[2-[(4-acetyl-1-piperazinyl)methyl]-4-pyridinyl]oxy]-1-naphthalenyl]amino]-oxomethyl]amino]-5-tert-butyl-2-methoxyphenyl]carbamic acid IUPAC Name: [3-[[4-[2-[(4-acetylpiperazin-1-yl)methyl]pyridin-4-yl]oxynaphthalen-1-yl]carbamoylamino]-5-tert-butyl-2-methoxyphenyl]carbamic acid Traditional Name: [3-[[4-[[2-[(4-acetylpiperazino)methyl]-4-pyridyl]oxy]-1-naphthyl]carbamoylamino]-5-tert-butyl-2-methoxy-phenyl]carbamic acid Formula: C35H40N6O6 MolecularWeight: 640.7287

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)CC2=NC=CC(=C2)OC3=CC=C(C4=CC=CC=C43)NC(=O)NC5=C(C(=CC(=C5)C(C)(C)C)NC(=O)O)OC

Isomeric SMILES

CC(=O)N1CCN(CC1)CC2=NC=CC(=C2)OC3=CC=C(C4=CC=CC=C43)NC(=O)NC5=C(C(=CC(=C5)C(C)(C)C)NC(=O)O)OC

InChI

InChI=1S/C35H40N6O6/c1-22(42)41-16-14-40(15-17-41)21-24-20-25(12-13-36-24)47-31-11-10-28(26-8-6-7-9-27(26)31)37-33(43)38-29-18-23(35(2,3)4)19-30(32(29)46-5)39-34(44)45/h6-13,18-20,39H,14-17,21H2,1-5H3,(H,44,45)(H2,37,38,43)