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

Systemtic Name: 1-[5-(3-azanyl-3-methyl-4-oxidanyl-butyl)thiophen-2-yl]-5-(4-ethylphenyl)pentan-1-one Openeye Name: 1-[5-(3-amino-4-hydroxy-3-methyl-butyl)-2-thienyl]-5-(4-ethylphenyl)pentan-1-one CAS Name: 1-[5-(3-amino-4-hydroxy-3-methylbutyl)-2-thiophenyl]-5-(4-ethylphenyl)-1-pentanone IUPAC Name: 1-[5-(3-amino-4-hydroxy-3-methylbutyl)thiophen-2-yl]-5-(4-ethylphenyl)pentan-1-one Traditional Name: 1-[5-(3-amino-4-hydroxy-3-methyl-butyl)-2-thienyl]-5-(4-ethylphenyl)pentan-1-one Formula: C22H31NO2S MolecularWeight: 373.55204

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CCCCC(=O)C2=CC=C(S2)CCC(C)(CO)N

Isomeric SMILES

CCC1=CC=C(C=C1)CCCCC(=O)C2=CC=C(S2)CCC(C)(CO)N

InChI

InChI=1S/C22H31NO2S/c1-3-17-8-10-18(11-9-17)6-4-5-7-20(25)21-13-12-19(26-21)14-15-22(2,23)16-24/h8-13,24H,3-7,14-16,23H2,1-2H3