methyl 2-[4-[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]sulfanylphenoxy]ethanoate

Systemtic Name: methyl 2-[4-[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]sulfanylphenoxy]ethanoate Openeye Name: methyl 2-[4-[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]sulfanylphenoxy]acetate CAS Name: 2-[4-[[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]thio]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]sulfanylphenoxy]acetate Traditional Name: 2-[4-[[4-(2-imidazolin-2-ylamino)phenyl]thio]phenoxy]acetic acid methyl ester Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=C(C=C1)SC2=CC=C(C=C2)NC3=NCCN3

Isomeric SMILES

COC(=O)COC1=CC=C(C=C1)SC2=CC=C(C=C2)NC3=NCCN3

InChI

InChI=1S/C18H19N3O3S/c1-23-17(22)12-24-14-4-8-16(9-5-14)25-15-6-2-13(3-7-15)21-18-19-10-11-20-18/h2-9H,10-12H2,1H3,(H2,19,20,21)