ethyl 2-[[2-[1-(1-benzofuran-2-ylcarbonyl)piperidin-4-yl]-1,3-thiazol-4-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: ethyl 2-[[2-[1-(1-benzofuran-2-ylcarbonyl)piperidin-4-yl]-1,3-thiazol-4-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: ethyl 2-[[2-[1-(benzofuran-2-carbonyl)-4-piperidyl]thiazole-4-carbonyl]amino]-3-phenyl-propanoate CAS Name: 2-[[[2-[1-[2-benzofuranyl(oxo)methyl]-4-piperidinyl]-4-thiazolyl]-oxomethyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[[2-[1-(1-benzofuran-2-carbonyl)piperidin-4-yl]-1,3-thiazole-4-carbonyl]amino]-3-phenylpropanoate Traditional Name: 2-[[2-[1-(benzofuran-2-carbonyl)-4-piperidyl]thiazole-4-carbonyl]amino]-3-phenyl-propionic acid ethyl ester Formula: C29H29N3O5S MolecularWeight: 531.62266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C4=CC5=CC=CC=C5O4

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C29H29N3O5S/c1-2-36-29(35)22(16-19-8-4-3-5-9-19)30-26(33)23-18-38-27(31-23)20-12-14-32(15-13-20)28(34)25-17-21-10-6-7-11-24(21)37-25/h3-11,17-18,20,22H,2,12-16H2,1H3,(H,30,33)