N-(3-pyrrolidin-1-ylpropyl)-2-[1-(2,3,4-trimethoxyphenyl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(3-pyrrolidin-1-ylpropyl)-2-[1-(2,3,4-trimethoxyphenyl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: N-(3-pyrrolidin-1-ylpropyl)-2-[1-(2,3,4-trimethoxybenzoyl)-4-piperidyl]thiazole-4-carboxamide CAS Name: 2-[1-[oxo-(2,3,4-trimethoxyphenyl)methyl]-4-piperidinyl]-N-[3-(1-pyrrolidinyl)propyl]-4-thiazolecarboxamide IUPAC Name: N-(3-pyrrolidin-1-ylpropyl)-2-[1-(2,3,4-trimethoxybenzoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: N-(3-pyrrolidinopropyl)-2-[1-(2,3,4-trimethoxybenzoyl)-4-piperidyl]thiazole-4-carboxamide Formula: C26H36N4O5S MolecularWeight: 516.65284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)NCCCN4CCCC4)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)NCCCN4CCCC4)OC)OC

InChI

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