3-chloranyl-3-[(3,5-dimethylphenyl)amino]sulfanyl-2,2-dimethyl-chromen-4-one

Systemtic Name: 3-chloranyl-3-[(3,5-dimethylphenyl)amino]sulfanyl-2,2-dimethyl-chromen-4-one Openeye Name: 3-chloro-3-(3,5-dimethylanilino)sulfanyl-2,2-dimethyl-chroman-4-one CAS Name: 3-chloro-N-(3,5-dimethylphenyl)-2,2-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-3-sulfenamide IUPAC Name: 3-chloro-3-(3,5-dimethylanilino)sulfanyl-2,2-dimethylchromen-4-one Traditional Name: 3-chloro-3-[(3,5-dimethylanilino)thio]-2,2-dimethyl-chroman-4-one Formula: C19H20ClNO2S MolecularWeight: 361.8856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NSC2(C(=O)C3=CC=CC=C3OC2(C)C)Cl)C

Isomeric SMILES

CC1=CC(=CC(=C1)NSC2(C(=O)C3=CC=CC=C3OC2(C)C)Cl)C

InChI

InChI=1S/C19H20ClNO2S/c1-12-9-13(2)11-14(10-12)21-24-19(20)17(22)15-7-5-6-8-16(15)23-18(19,3)4/h5-11,21H,1-4H3