2-azanyl-2-methyl-4-[3-methyl-5-(4-phenylmethoxybutyl)thiophen-2-yl]butan-1-ol

Systemtic Name: 2-azanyl-2-methyl-4-[3-methyl-5-(4-phenylmethoxybutyl)thiophen-2-yl]butan-1-ol Openeye Name: 2-amino-4-[5-(4-benzyloxybutyl)-3-methyl-2-thienyl]-2-methyl-butan-1-ol CAS Name: 2-amino-2-methyl-4-[3-methyl-5-(4-phenylmethoxybutyl)-2-thiophenyl]-1-butanol IUPAC Name: 2-amino-2-methyl-4-[3-methyl-5-(4-phenylmethoxybutyl)thiophen-2-yl]butan-1-ol Traditional Name: 2-amino-4-[5-(4-benzoxybutyl)-3-methyl-2-thienyl]-2-methyl-butan-1-ol Formula: C21H31NO2S MolecularWeight: 361.54134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)CCCCOCC2=CC=CC=C2)CCC(C)(CO)N

Isomeric SMILES

CC1=C(SC(=C1)CCCCOCC2=CC=CC=C2)CCC(C)(CO)N

InChI

InChI=1S/C21H31NO2S/c1-17-14-19(25-20(17)11-12-21(2,22)16-23)10-6-7-13-24-15-18-8-4-3-5-9-18/h3-5,8-9,14,23H,6-7,10-13,15-16,22H2,1-2H3