1-[5-[3-methyl-3-(methylamino)-4-oxidanyl-butyl]thiophen-2-yl]-5-phenyl-pentan-1-one

Systemtic Name: 1-[5-[3-methyl-3-(methylamino)-4-oxidanyl-butyl]thiophen-2-yl]-5-phenyl-pentan-1-one Openeye Name: 1-[5-[4-hydroxy-3-methyl-3-(methylamino)butyl]-2-thienyl]-5-phenyl-pentan-1-one CAS Name: 1-[5-[4-hydroxy-3-methyl-3-(methylamino)butyl]-2-thiophenyl]-5-phenyl-1-pentanone IUPAC Name: 1-[5-[4-hydroxy-3-methyl-3-(methylamino)butyl]thiophen-2-yl]-5-phenylpentan-1-one Traditional Name: 1-[5-[4-hydroxy-3-methyl-3-(methylamino)butyl]-2-thienyl]-5-phenyl-pentan-1-one Formula: C21H29NO2S MolecularWeight: 359.52546

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(S1)C(=O)CCCCC2=CC=CC=C2)(CO)NC

Isomeric SMILES

CC(CCC1=CC=C(S1)C(=O)CCCCC2=CC=CC=C2)(CO)NC

InChI

InChI=1S/C21H29NO2S/c1-21(16-23,22-2)15-14-18-12-13-20(25-18)19(24)11-7-6-10-17-8-4-3-5-9-17/h3-5,8-9,12-13,22-23H,6-7,10-11,14-16H2,1-2H3