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

Systemtic Name: 5-chloranyl-N-methyl-N-[(4-methylsulfanylphenyl)methyl]-2,3-dihydro-1-benzofuran-2-carboxamide Openeye Name: 5-chloro-N-methyl-N-[(4-methylsulfanylphenyl)methyl]-2,3-dihydrobenzofuran-2-carboxamide CAS Name: 5-chloro-N-methyl-N-[[4-(methylthio)phenyl]methyl]-2,3-dihydrobenzofuran-2-carboxamide IUPAC Name: 5-chloro-N-methyl-N-[(4-methylsulfanylphenyl)methyl]-2,3-dihydro-1-benzofuran-2-carboxamide Traditional Name: 5-chloro-N-methyl-N-[4-(methylthio)benzyl]coumaran-2-carboxamide Formula: C18H18ClNO2S MolecularWeight: 347.85902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18ClNO2S/c1-20(11-12-3-6-15(23-2)7-4-12)18(21)17-10-13-9-14(19)5-8-16(13)22-17/h3-9,17H,10-11H2,1-2H3