N-[2-(3-methoxyphenyl)ethyl]-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-[2-(3-methoxyphenyl)ethyl]-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: N-[2-(3-methoxyphenyl)ethyl]-2-[1-(3-phenylprop-2-ynoyl)-4-piperidyl]thiazole-4-carboxamide CAS Name: N-[2-(3-methoxyphenyl)ethyl]-2-[1-(1-oxo-3-phenylprop-2-ynyl)-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-[2-(3-methoxyphenyl)ethyl]-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: N-[2-(3-methoxyphenyl)ethyl]-2-[1-(3-phenylpropioloyl)-4-piperidyl]thiazole-4-carboxamide Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CCNC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C#CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)CCNC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C#CC4=CC=CC=C4

InChI

InChI=1S/C27H27N3O3S/c1-33-23-9-5-8-21(18-23)12-15-28-26(32)24-19-34-27(29-24)22-13-16-30(17-14-22)25(31)11-10-20-6-3-2-4-7-20/h2-9,18-19,22H,12-17H2,1H3,(H,28,32)