N-[2-chloranyl-4-[3-(4-methoxyoxan-2-yl)phenyl]sulfanyl-phenyl]-N-methyl-propanamide

Systemtic Name: N-[2-chloranyl-4-[3-(4-methoxyoxan-2-yl)phenyl]sulfanyl-phenyl]-N-methyl-propanamide Openeye Name: N-[2-chloro-4-[3-(4-methoxytetrahydropyran-2-yl)phenyl]sulfanyl-phenyl]-N-methyl-propanamide CAS Name: N-[2-chloro-4-[[3-(4-methoxy-2-oxanyl)phenyl]thio]phenyl]-N-methylpropanamide IUPAC Name: N-[2-chloro-4-[3-(4-methoxyoxan-2-yl)phenyl]sulfanylphenyl]-N-methylpropanamide Traditional Name: N-[2-chloro-4-[[3-(4-methoxytetrahydropyran-2-yl)phenyl]thio]phenyl]-N-methyl-propionamide Formula: C22H26ClNO3S MolecularWeight: 419.96474

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C)C1=C(C=C(C=C1)SC2=CC=CC(=C2)C3CC(CCO3)OC)Cl

Isomeric SMILES

CCC(=O)N(C)C1=C(C=C(C=C1)SC2=CC=CC(=C2)C3CC(CCO3)OC)Cl

InChI

InChI=1S/C22H26ClNO3S/c1-4-22(25)24(2)20-9-8-18(14-19(20)23)28-17-7-5-6-15(12-17)21-13-16(26-3)10-11-27-21/h5-9,12,14,16,21H,4,10-11,13H2,1-3H3