1-[[6-methoxy-1-(phenylmethyl)-3,4-dihydroisothiochromen-1-yl]methyl]imidazole

Systemtic Name: 1-[[6-methoxy-1-(phenylmethyl)-3,4-dihydroisothiochromen-1-yl]methyl]imidazole Openeye Name: 1-[(1-benzyl-6-methoxy-isothiochroman-1-yl)methyl]imidazole CAS Name: 1-[[6-methoxy-1-(phenylmethyl)-3,4-dihydro-2-benzothiopyran-1-yl]methyl]imidazole IUPAC Name: 1-[(1-benzyl-6-methoxy-3,4-dihydroisothiochromen-1-yl)methyl]imidazole Traditional Name: 1-[(1-benzyl-6-methoxy-isothiochroman-1-yl)methyl]imidazole Formula: C21H22N2OS MolecularWeight: 350.47718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(SCC2)(CC3=CC=CC=C3)CN4C=CN=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C(SCC2)(CC3=CC=CC=C3)CN4C=CN=C4

InChI

InChI=1S/C21H22N2OS/c1-24-19-7-8-20-18(13-19)9-12-25-21(20,15-23-11-10-22-16-23)14-17-5-3-2-4-6-17/h2-8,10-11,13,16H,9,12,14-15H2,1H3