1-(3-methylbutylamino)-3-(4-thiophen-3-ylphenoxy)propan-2-ol

Systemtic Name: 1-(3-methylbutylamino)-3-(4-thiophen-3-ylphenoxy)propan-2-ol Openeye Name: 1-(isopentylamino)-3-[4-(3-thienyl)phenoxy]propan-2-ol CAS Name: 1-(3-methylbutylamino)-3-[4-(3-thiophenyl)phenoxy]-2-propanol IUPAC Name: 1-(3-methylbutylamino)-3-(4-thiophen-3-ylphenoxy)propan-2-ol Traditional Name: 1-(isoamylamino)-3-[4-(3-thienyl)phenoxy]propan-2-ol Formula: C18H25NO2S MolecularWeight: 319.4616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNCC(COC1=CC=C(C=C1)C2=CSC=C2)O

Isomeric SMILES

CC(C)CCNCC(COC1=CC=C(C=C1)C2=CSC=C2)O

InChI

InChI=1S/C18H25NO2S/c1-14(2)7-9-19-11-17(20)12-21-18-5-3-15(4-6-18)16-8-10-22-13-16/h3-6,8,10,13-14,17,19-20H,7,9,11-12H2,1-2H3