(3S,4R)-N-(4-bromophenyl)-3-methoxy-4-methyl-3,4-dihydroisothiochromen-1-imine

Systemtic Name: (3S,4R)-N-(4-bromophenyl)-3-methoxy-4-methyl-3,4-dihydroisothiochromen-1-imine Openeye Name: (3S,4R)-N-(4-bromophenyl)-3-methoxy-4-methyl-isothiochroman-1-imine CAS Name: (3S,4R)-N-(4-bromophenyl)-3-methoxy-4-methyl-3,4-dihydro-2-benzothiopyran-1-imine IUPAC Name: (3S,4R)-N-(4-bromophenyl)-3-methoxy-4-methyl-3,4-dihydroisothiochromen-1-imine Traditional Name: (4-bromophenyl)-[(3S,4R)-3-methoxy-4-methyl-isothiochroman-1-ylidene]amine Formula: C17H16BrNOS MolecularWeight: 362.28404

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(SC(=NC2=CC=C(C=C2)Br)C3=CC=CC=C13)OC

Isomeric SMILES

C[C@H]1[C@H](SC(=NC2=CC=C(C=C2)Br)C3=CC=CC=C13)OC

InChI

InChI=1S/C17H16BrNOS/c1-11-14-5-3-4-6-15(14)16(21-17(11)20-2)19-13-9-7-12(18)8-10-13/h3-11,17H,1-2H3/t11-,17+/m1/s1