1-(3-imidazol-1-ylpropylamino)-3-[4-[(4-methoxyphenyl)-thiophen-2-yl-methyl]phenoxy]propan-2-ol

Systemtic Name: 1-(3-imidazol-1-ylpropylamino)-3-[4-[(4-methoxyphenyl)-thiophen-2-yl-methyl]phenoxy]propan-2-ol Openeye Name: 1-(3-imidazol-1-ylpropylamino)-3-[4-[(4-methoxyphenyl)-(2-thienyl)methyl]phenoxy]propan-2-ol CAS Name: 1-[3-(1-imidazolyl)propylamino]-3-[4-[(4-methoxyphenyl)-thiophen-2-ylmethyl]phenoxy]-2-propanol IUPAC Name: 1-(3-imidazol-1-ylpropylamino)-3-[4-[(4-methoxyphenyl)-thiophen-2-ylmethyl]phenoxy]propan-2-ol Traditional Name: 1-(3-imidazol-1-ylpropylamino)-3-[4-[(4-methoxyphenyl)-(2-thienyl)methyl]phenoxy]propan-2-ol Formula: C27H31N3O3S MolecularWeight: 477.61834

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OCC(CNCCCN3C=CN=C3)O)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OCC(CNCCCN3C=CN=C3)O)C4=CC=CS4

InChI

InChI=1S/C27H31N3O3S/c1-32-24-9-5-21(6-10-24)27(26-4-2-17-34-26)22-7-11-25(12-8-22)33-19-23(31)18-28-13-3-15-30-16-14-29-20-30/h2,4-12,14,16-17,20,23,27-28,31H,3,13,15,18-19H2,1H3