2-[2-ethoxy-4-[4-(thiophen-3-ylmethyl)piperazin-1-yl]carbonyl-phenoxy]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[2-ethoxy-4-[4-(thiophen-3-ylmethyl)piperazin-1-yl]carbonyl-phenoxy]-1-piperidin-1-yl-ethanone Openeye Name: 2-[2-ethoxy-4-[4-(3-thienylmethyl)piperazine-1-carbonyl]phenoxy]-1-(1-piperidyl)ethanone CAS Name: 2-[2-ethoxy-4-[oxo-[4-(3-thiophenylmethyl)-1-piperazinyl]methyl]phenoxy]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[2-ethoxy-4-[4-(thiophen-3-ylmethyl)piperazine-1-carbonyl]phenoxy]-1-piperidin-1-ylethanone Traditional Name: 2-[2-ethoxy-4-[4-(3-thenyl)piperazine-1-carbonyl]phenoxy]-1-piperidino-ethanone Formula: C25H33N3O4S MolecularWeight: 471.61222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)CC3=CSC=C3)OCC(=O)N4CCCCC4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)CC3=CSC=C3)OCC(=O)N4CCCCC4

InChI

InChI=1S/C25H33N3O4S/c1-2-31-23-16-21(6-7-22(23)32-18-24(29)27-9-4-3-5-10-27)25(30)28-13-11-26(12-14-28)17-20-8-15-33-19-20/h6-8,15-16,19H,2-5,9-14,17-18H2,1H3