2-azanyl-4-[4-[3-(4-ethylphenoxy)prop-1-ynylsulfanyl]phenyl]-2-methyl-butan-1-ol

Systemtic Name: 2-azanyl-4-[4-[3-(4-ethylphenoxy)prop-1-ynylsulfanyl]phenyl]-2-methyl-butan-1-ol Openeye Name: 2-amino-4-[4-[3-(4-ethylphenoxy)prop-1-ynylsulfanyl]phenyl]-2-methyl-butan-1-ol CAS Name: 2-amino-4-[4-[3-(4-ethylphenoxy)prop-1-ynylthio]phenyl]-2-methyl-1-butanol IUPAC Name: 2-amino-4-[4-[3-(4-ethylphenoxy)prop-1-ynylsulfanyl]phenyl]-2-methylbutan-1-ol Traditional Name: 2-amino-4-[4-[3-(4-ethylphenoxy)prop-1-ynylthio]phenyl]-2-methyl-butan-1-ol Formula: C22H27NO2S MolecularWeight: 369.52028

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC#CSC2=CC=C(C=C2)CCC(C)(CO)N

Isomeric SMILES

CCC1=CC=C(C=C1)OCC#CSC2=CC=C(C=C2)CCC(C)(CO)N

InChI

InChI=1S/C22H27NO2S/c1-3-18-5-9-20(10-6-18)25-15-4-16-26-21-11-7-19(8-12-21)13-14-22(2,23)17-24/h5-12,24H,3,13-15,17,23H2,1-2H3