1-[5-[3-azanyl-3-(hydroxymethyl)pentyl]thiophen-2-yl]-4-phenyl-butan-1-one

Systemtic Name: 1-[5-[3-azanyl-3-(hydroxymethyl)pentyl]thiophen-2-yl]-4-phenyl-butan-1-one Openeye Name: 1-[5-[3-amino-3-(hydroxymethyl)pentyl]-2-thienyl]-4-phenyl-butan-1-one CAS Name: 1-[5-[3-amino-3-(hydroxymethyl)pentyl]-2-thiophenyl]-4-phenyl-1-butanone IUPAC Name: 1-[5-[3-amino-3-(hydroxymethyl)pentyl]thiophen-2-yl]-4-phenylbutan-1-one Traditional Name: 1-[5-(3-amino-3-methylol-pentyl)-2-thienyl]-4-phenyl-butan-1-one Formula: C20H27NO2S MolecularWeight: 345.49888

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1=CC=C(S1)C(=O)CCCC2=CC=CC=C2)(CO)N

Isomeric SMILES

CCC(CCC1=CC=C(S1)C(=O)CCCC2=CC=CC=C2)(CO)N

InChI

InChI=1S/C20H27NO2S/c1-2-20(21,15-22)14-13-17-11-12-19(24-17)18(23)10-6-9-16-7-4-3-5-8-16/h3-5,7-8,11-12,22H,2,6,9-10,13-15,21H2,1H3