N-[(4-fluorophenyl)-thiophen-2-yl-methyl]-2-(2-piperidin-1-ylcarbonyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethanamide

Systemtic Name: N-[(4-fluorophenyl)-thiophen-2-yl-methyl]-2-(2-piperidin-1-ylcarbonyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethanamide Openeye Name: N-[(4-fluorophenyl)-(2-thienyl)methyl]-2-[2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazin-4-yl]acetamide CAS Name: N-[(4-fluorophenyl)-thiophen-2-ylmethyl]-2-[2-[oxo(1-piperidinyl)methyl]-2,3-dihydro-1,4-benzoxazin-4-yl]acetamide IUPAC Name: N-[(4-fluorophenyl)-thiophen-2-ylmethyl]-2-[2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazin-4-yl]acetamide Traditional Name: N-[(4-fluorophenyl)-(2-thienyl)methyl]-2-[2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazin-4-yl]acetamide Formula: C27H28FN3O3S MolecularWeight: 493.592923

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2CN(C3=CC=CC=C3O2)CC(=O)NC(C4=CC=C(C=C4)F)C5=CC=CS5

Isomeric SMILES

C1CCN(CC1)C(=O)C2CN(C3=CC=CC=C3O2)CC(=O)NC(C4=CC=C(C=C4)F)C5=CC=CS5

InChI

InChI=1S/C27H28FN3O3S/c28-20-12-10-19(11-13-20)26(24-9-6-16-35-24)29-25(32)18-31-17-23(27(33)30-14-4-1-5-15-30)34-22-8-3-2-7-21(22)31/h2-3,6-13,16,23,26H,1,4-5,14-15,17-18H2,(H,29,32)