4-bromanyl-N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-3,5-dimethoxy-benzamide

Systemtic Name: 4-bromanyl-N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-3,5-dimethoxy-benzamide Openeye Name: 4-bromo-N-(6-chlorothiochroman-4-yl)-3,5-dimethoxy-benzamide CAS Name: 4-bromo-N-(6-chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-3,5-dimethoxybenzamide IUPAC Name: 4-bromo-N-(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)-3,5-dimethoxybenzamide Traditional Name: 4-bromo-N-(6-chlorothiochroman-4-yl)-3,5-dimethoxy-benzamide Formula: C18H17BrClNO3S MolecularWeight: 442.75448

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1Br)OC)C(=O)NC2CCSC3=C2C=C(C=C3)Cl

Isomeric SMILES

COC1=CC(=CC(=C1Br)OC)C(=O)NC2CCSC3=C2C=C(C=C3)Cl

InChI

InChI=1S/C18H17BrClNO3S/c1-23-14-7-10(8-15(24-2)17(14)19)18(22)21-13-5-6-25-16-4-3-11(20)9-12(13)16/h3-4,7-9,13H,5-6H2,1-2H3,(H,21,22)