5-chloranyl-N-[3-(1,3-dithian-2-yl)phenyl]-2,3-dihydro-1-benzofuran-2-carboxamide

Systemtic Name: 5-chloranyl-N-[3-(1,3-dithian-2-yl)phenyl]-2,3-dihydro-1-benzofuran-2-carboxamide Openeye Name: 5-chloro-N-[3-(1,3-dithian-2-yl)phenyl]-2,3-dihydrobenzofuran-2-carboxamide CAS Name: 5-chloro-N-[3-(1,3-dithian-2-yl)phenyl]-2,3-dihydrobenzofuran-2-carboxamide IUPAC Name: 5-chloro-N-[3-(1,3-dithian-2-yl)phenyl]-2,3-dihydro-1-benzofuran-2-carboxamide Traditional Name: 5-chloro-N-[3-(1,3-dithian-2-yl)phenyl]coumaran-2-carboxamide Formula: C19H18ClNO2S2 MolecularWeight: 391.93472

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=CC(=CC=C2)NC(=O)C3CC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

C1CSC(SC1)C2=CC(=CC=C2)NC(=O)C3CC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C19H18ClNO2S2/c20-14-5-6-16-13(9-14)11-17(23-16)18(22)21-15-4-1-3-12(10-15)19-24-7-2-8-25-19/h1,3-6,9-10,17,19H,2,7-8,11H2,(H,21,22)