5-chloranyl-N-[2-(4-methylphenyl)sulfanylethyl]-2,3-dihydro-1-benzofuran-2-carboxamide

Systemtic Name: 5-chloranyl-N-[2-(4-methylphenyl)sulfanylethyl]-2,3-dihydro-1-benzofuran-2-carboxamide Openeye Name: 5-chloro-N-[2-(p-tolylsulfanyl)ethyl]-2,3-dihydrobenzofuran-2-carboxamide CAS Name: 5-chloro-N-[2-[(4-methylphenyl)thio]ethyl]-2,3-dihydrobenzofuran-2-carboxamide IUPAC Name: 5-chloro-N-[2-(4-methylphenyl)sulfanylethyl]-2,3-dihydro-1-benzofuran-2-carboxamide Traditional Name: 5-chloro-N-[2-(p-tolylthio)ethyl]coumaran-2-carboxamide Formula: C18H18ClNO2S MolecularWeight: 347.85902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C2CC3=C(O2)C=CC(=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C2CC3=C(O2)C=CC(=C3)Cl

InChI

InChI=1S/C18H18ClNO2S/c1-12-2-5-15(6-3-12)23-9-8-20-18(21)17-11-13-10-14(19)4-7-16(13)22-17/h2-7,10,17H,8-9,11H2,1H3,(H,20,21)