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

Systemtic Name: N-[2-chloranyl-4-[3-(4-methoxyoxan-4-yl)phenyl]sulfanyl-phenyl]propanamide Openeye Name: N-[2-chloro-4-[3-(4-methoxytetrahydropyran-4-yl)phenyl]sulfanyl-phenyl]propanamide CAS Name: N-[2-chloro-4-[[3-(4-methoxy-4-oxanyl)phenyl]thio]phenyl]propanamide IUPAC Name: N-[2-chloro-4-[3-(4-methoxyoxan-4-yl)phenyl]sulfanylphenyl]propanamide Traditional Name: N-[2-chloro-4-[[3-(4-methoxytetrahydropyran-4-yl)phenyl]thio]phenyl]propionamide Formula: C21H24ClNO3S MolecularWeight: 405.93816

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=C(C=C1)SC2=CC=CC(=C2)C3(CCOCC3)OC)Cl

Isomeric SMILES

CCC(=O)NC1=C(C=C(C=C1)SC2=CC=CC(=C2)C3(CCOCC3)OC)Cl

InChI

InChI=1S/C21H24ClNO3S/c1-3-20(24)23-19-8-7-17(14-18(19)22)27-16-6-4-5-15(13-16)21(25-2)9-11-26-12-10-21/h4-8,13-14H,3,9-12H2,1-2H3,(H,23,24)