1-[4-[5-[5-(3-azanyl-3-methyl-4-oxidanyl-butyl)thiophen-2-yl]pent-4-ynyl]phenyl]ethanone

Systemtic Name: 1-[4-[5-[5-(3-azanyl-3-methyl-4-oxidanyl-butyl)thiophen-2-yl]pent-4-ynyl]phenyl]ethanone Openeye Name: 1-[4-[5-[5-(3-amino-4-hydroxy-3-methyl-butyl)-2-thienyl]pent-4-ynyl]phenyl]ethanone CAS Name: 1-[4-[5-[5-(3-amino-4-hydroxy-3-methylbutyl)-2-thiophenyl]pent-4-ynyl]phenyl]ethanone IUPAC Name: 1-[4-[5-[5-(3-amino-4-hydroxy-3-methylbutyl)thiophen-2-yl]pent-4-ynyl]phenyl]ethanone Traditional Name: 1-[4-[5-[5-(3-amino-4-hydroxy-3-methyl-butyl)-2-thienyl]pent-4-ynyl]phenyl]ethanone Formula: C22H27NO2S MolecularWeight: 369.52028

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)CCCC#CC2=CC=C(S2)CCC(C)(CO)N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)CCCC#CC2=CC=C(S2)CCC(C)(CO)N

InChI

InChI=1S/C22H27NO2S/c1-17(25)19-10-8-18(9-11-19)6-4-3-5-7-20-12-13-21(26-20)14-15-22(2,23)16-24/h8-13,24H,3-4,6,14-16,23H2,1-2H3