1-[5-[3-azanyl-3-(hydroxymethyl)pentyl]thiophen-2-yl]-5-cyclohexyl-pentan-1-one

Systemtic Name: 1-[5-[3-azanyl-3-(hydroxymethyl)pentyl]thiophen-2-yl]-5-cyclohexyl-pentan-1-one Openeye Name: 1-[5-[3-amino-3-(hydroxymethyl)pentyl]-2-thienyl]-5-cyclohexyl-pentan-1-one CAS Name: 1-[5-[3-amino-3-(hydroxymethyl)pentyl]-2-thiophenyl]-5-cyclohexyl-1-pentanone IUPAC Name: 1-[5-[3-amino-3-(hydroxymethyl)pentyl]thiophen-2-yl]-5-cyclohexylpentan-1-one Traditional Name: 1-[5-(3-amino-3-methylol-pentyl)-2-thienyl]-5-cyclohexyl-pentan-1-one Formula: C21H35NO2S MolecularWeight: 365.5731

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1=CC=C(S1)C(=O)CCCCC2CCCCC2)(CO)N

Isomeric SMILES

CCC(CCC1=CC=C(S1)C(=O)CCCCC2CCCCC2)(CO)N

InChI

InChI=1S/C21H35NO2S/c1-2-21(22,16-23)15-14-18-12-13-20(25-18)19(24)11-7-6-10-17-8-4-3-5-9-17/h12-13,17,23H,2-11,14-16,22H2,1H3