N-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-methoxyphenyl)thio]propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxyphenyl)sulfanylpropanamide Traditional Name: 3-[(4-methoxyphenyl)thio]-N-piperonyl-propionamide Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCCC(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC1=CC=C(C=C1)SCCC(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H19NO4S/c1-21-14-3-5-15(6-4-14)24-9-8-18(20)19-11-13-2-7-16-17(10-13)23-12-22-16/h2-7,10H,8-9,11-12H2,1H3,(H,19,20)