N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-3,4-dihydro-1H-isothiochromen-4-amine

Systemtic Name: N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-3,4-dihydro-1H-isothiochromen-4-amine Openeye Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)isothiochroman-4-amine CAS Name: N-(4-chloro-2-methoxy-5-methylphenyl)-3,4-dihydro-1H-2-benzothiopyran-4-amine IUPAC Name: N-(4-chloro-2-methoxy-5-methylphenyl)-3,4-dihydro-1H-isothiochromen-4-amine Traditional Name: (4-chloro-2-methoxy-5-methyl-phenyl)-isothiochroman-4-yl-amine Formula: C17H18ClNOS MolecularWeight: 319.84892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC2CSCC3=CC=CC=C23

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC2CSCC3=CC=CC=C23

InChI

InChI=1S/C17H18ClNOS/c1-11-7-15(17(20-2)8-14(11)18)19-16-10-21-9-12-5-3-4-6-13(12)16/h3-8,16,19H,9-10H2,1-2H3