N-methylethanamide; 4-[[4-(phenylmethylsulfanyl)phenyl]methoxymethyl]oxane

Systemtic Name: N-methylethanamide; 4-[[4-(phenylmethylsulfanyl)phenyl]methoxymethyl]oxane Openeye Name: 4-[(4-benzylsulfanylphenyl)methoxymethyl]tetrahydropyran; N-methylacetamide CAS Name: N-methylacetamide; 4-[[4-(phenylmethylthio)phenyl]methoxymethyl]oxane IUPAC Name: 4-[(4-benzylsulfanylphenyl)methoxymethyl]oxane; N-methylacetamide Traditional Name: 4-[[4-(benzylthio)benzyl]oxymethyl]tetrahydropyran; N-methylacetamide Formula: C23H31NO3S MolecularWeight: 401.56214

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC.C1COCCC1COCC2=CC=C(C=C2)SCC3=CC=CC=C3

Isomeric SMILES

CC(=O)NC.C1COCCC1COCC2=CC=C(C=C2)SCC3=CC=CC=C3

InChI

InChI=1S/C20H24O2S.C3H7NO/c1-2-4-19(5-3-1)16-23-20-8-6-17(7-9-20)14-22-15-18-10-12-21-13-11-18;1-3(5)4-2/h1-9,18H,10-16H2;1-2H3,(H,4,5)