N-(4-bromanyl-3-methyl-phenyl)-3,4-dihydro-1H-isothiochromen-4-amine

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-3,4-dihydro-1H-isothiochromen-4-amine Openeye Name: N-(4-bromo-3-methyl-phenyl)isothiochroman-4-amine CAS Name: N-(4-bromo-3-methylphenyl)-3,4-dihydro-1H-2-benzothiopyran-4-amine IUPAC Name: N-(4-bromo-3-methylphenyl)-3,4-dihydro-1H-isothiochromen-4-amine Traditional Name: (4-bromo-3-methyl-phenyl)-isothiochroman-4-yl-amine Formula: C16H16BrNS MolecularWeight: 334.27394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2CSCC3=CC=CC=C23)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC2CSCC3=CC=CC=C23)Br

InChI

InChI=1S/C16H16BrNS/c1-11-8-13(6-7-15(11)17)18-16-10-19-9-12-4-2-3-5-14(12)16/h2-8,16,18H,9-10H2,1H3