2-azanyl-4-[5-[2-(4-butylphenyl)ethynyl]thiophen-2-yl]-2-methyl-butan-1-ol

Systemtic Name: 2-azanyl-4-[5-[2-(4-butylphenyl)ethynyl]thiophen-2-yl]-2-methyl-butan-1-ol Openeye Name: 2-amino-4-[5-[2-(4-butylphenyl)ethynyl]-2-thienyl]-2-methyl-butan-1-ol CAS Name: 2-amino-4-[5-[2-(4-butylphenyl)ethynyl]-2-thiophenyl]-2-methyl-1-butanol IUPAC Name: 2-amino-4-[5-[2-(4-butylphenyl)ethynyl]thiophen-2-yl]-2-methylbutan-1-ol Traditional Name: 2-amino-4-[5-[2-(4-butylphenyl)ethynyl]-2-thienyl]-2-methyl-butan-1-ol Formula: C21H27NOS MolecularWeight: 341.51018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C#CC2=CC=C(S2)CCC(C)(CO)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)C#CC2=CC=C(S2)CCC(C)(CO)N

InChI

InChI=1S/C21H27NOS/c1-3-4-5-17-6-8-18(9-7-17)10-11-19-12-13-20(24-19)14-15-21(2,22)16-23/h6-9,12-13,23H,3-5,14-16,22H2,1-2H3