ethyl 3-phenyl-2-[[2-[1-(4-pyridin-2-ylpiperazin-1-yl)carbonylpiperidin-4-yl]-1,3-thiazol-4-yl]carbonylamino]propanoate

Systemtic Name: ethyl 3-phenyl-2-[[2-[1-(4-pyridin-2-ylpiperazin-1-yl)carbonylpiperidin-4-yl]-1,3-thiazol-4-yl]carbonylamino]propanoate Openeye Name: ethyl 3-phenyl-2-[[2-[1-[4-(2-pyridyl)piperazine-1-carbonyl]-4-piperidyl]thiazole-4-carbonyl]amino]propanoate CAS Name: 2-[[oxo-[2-[1-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-4-piperidinyl]-4-thiazolyl]methyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 3-phenyl-2-[[2-[1-(4-pyridin-2-ylpiperazine-1-carbonyl)piperidin-4-yl]-1,3-thiazole-4-carbonyl]amino]propanoate Traditional Name: 3-phenyl-2-[[2-[1-[4-(2-pyridyl)piperazine-1-carbonyl]-4-piperidyl]thiazole-4-carbonyl]amino]propionic acid ethyl ester Formula: C30H36N6O4S MolecularWeight: 576.70964

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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)N4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)N4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C30H36N6O4S/c1-2-40-29(38)24(20-22-8-4-3-5-9-22)32-27(37)25-21-41-28(33-25)23-11-14-35(15-12-23)30(39)36-18-16-34(17-19-36)26-10-6-7-13-31-26/h3-10,13,21,23-24H,2,11-12,14-20H2,1H3,(H,32,37)