N-[3-[1-(2,2-dimethylpropyl)piperidin-4-yl]-1-benzothiophen-5-yl]-5-phenoxy-pentanamide

Systemtic Name: N-[3-[1-(2,2-dimethylpropyl)piperidin-4-yl]-1-benzothiophen-5-yl]-5-phenoxy-pentanamide Openeye Name: N-[3-[1-(2,2-dimethylpropyl)-4-piperidyl]benzothiophen-5-yl]-5-phenoxy-pentanamide CAS Name: N-[3-[1-(2,2-dimethylpropyl)-4-piperidinyl]-1-benzothiophen-5-yl]-5-phenoxypentanamide IUPAC Name: N-[3-[1-(2,2-dimethylpropyl)piperidin-4-yl]-1-benzothiophen-5-yl]-5-phenoxypentanamide Traditional Name: N-[3-(1-neopentyl-4-piperidyl)benzothiophen-5-yl]-5-phenoxy-valeramide Formula: C29H38N2O2S MolecularWeight: 478.68922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1CCC(CC1)C2=CSC3=C2C=C(C=C3)NC(=O)CCCCOC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)CN1CCC(CC1)C2=CSC3=C2C=C(C=C3)NC(=O)CCCCOC4=CC=CC=C4

InChI

InChI=1S/C29H38N2O2S/c1-29(2,3)21-31-16-14-22(15-17-31)26-20-34-27-13-12-23(19-25(26)27)30-28(32)11-7-8-18-33-24-9-5-4-6-10-24/h4-6,9-10,12-13,19-20,22H,7-8,11,14-18,21H2,1-3H3,(H,30,32)