1-[5-(3-azanyl-3-methyl-4-oxidanyl-butyl)thiophen-2-yl]-5-(3,4,5-trimethoxyphenyl)pentan-1-one

Systemtic Name: 1-[5-(3-azanyl-3-methyl-4-oxidanyl-butyl)thiophen-2-yl]-5-(3,4,5-trimethoxyphenyl)pentan-1-one Openeye Name: 1-[5-(3-amino-4-hydroxy-3-methyl-butyl)-2-thienyl]-5-(3,4,5-trimethoxyphenyl)pentan-1-one CAS Name: 1-[5-(3-amino-4-hydroxy-3-methylbutyl)-2-thiophenyl]-5-(3,4,5-trimethoxyphenyl)-1-pentanone IUPAC Name: 1-[5-(3-amino-4-hydroxy-3-methylbutyl)thiophen-2-yl]-5-(3,4,5-trimethoxyphenyl)pentan-1-one Traditional Name: 1-[5-(3-amino-4-hydroxy-3-methyl-butyl)-2-thienyl]-5-(3,4,5-trimethoxyphenyl)pentan-1-one Formula: C23H33NO5S MolecularWeight: 435.57682

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(S1)C(=O)CCCCC2=CC(=C(C(=C2)OC)OC)OC)(CO)N

Isomeric SMILES

CC(CCC1=CC=C(S1)C(=O)CCCCC2=CC(=C(C(=C2)OC)OC)OC)(CO)N

InChI

InChI=1S/C23H33NO5S/c1-23(24,15-25)12-11-17-9-10-21(30-17)18(26)8-6-5-7-16-13-19(27-2)22(29-4)20(14-16)28-3/h9-10,13-14,25H,5-8,11-12,15,24H2,1-4H3