ethyl 3-[[4-[4-(C-ethoxycarbonimidoyl)phenyl]-1,3-thiazol-2-yl]-[1-(2-ethoxy-2-oxidanylidene-ethyl)piperidin-4-yl]amino]propanoate

Systemtic Name: ethyl 3-[[4-[4-(C-ethoxycarbonimidoyl)phenyl]-1,3-thiazol-2-yl]-[1-(2-ethoxy-2-oxidanylidene-ethyl)piperidin-4-yl]amino]propanoate Openeye Name: ethyl 3-[[4-[4-(ethoxycarbonimidoyl)phenyl]thiazol-2-yl]-[1-(2-ethoxy-2-oxo-ethyl)-4-piperidyl]amino]propanoate CAS Name: 3-[[4-[4-[ethoxy(imino)methyl]phenyl]-2-thiazolyl]-[1-(2-ethoxy-2-oxoethyl)-4-piperidinyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[4-[4-(C-ethoxycarbonimidoyl)phenyl]-1,3-thiazol-2-yl]-[1-(2-ethoxy-2-oxoethyl)piperidin-4-yl]amino]propanoate Traditional Name: 3-[[4-[4-(ethoxycarbonimidoyl)phenyl]thiazol-2-yl]-[1-(2-ethoxy-2-keto-ethyl)-4-piperidyl]amino]propionic acid ethyl ester Formula: C26H36N4O5S MolecularWeight: 516.65284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(C1CCN(CC1)CC(=O)OCC)C2=NC(=CS2)C3=CC=C(C=C3)C(=N)OCC

Isomeric SMILES

CCOC(=O)CCN(C1CCN(CC1)CC(=O)OCC)C2=NC(=CS2)C3=CC=C(C=C3)C(=N)OCC

InChI

InChI=1S/C26H36N4O5S/c1-4-33-23(31)13-16-30(21-11-14-29(15-12-21)17-24(32)34-5-2)26-28-22(18-36-26)19-7-9-20(10-8-19)25(27)35-6-3/h7-10,18,21,27H,4-6,11-17H2,1-3H3