2-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]sulfanyl-N-[2-(4-methoxyphenyl)ethyl]ethanamide

Systemtic Name: 2-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]sulfanyl-N-[2-(4-methoxyphenyl)ethyl]ethanamide Openeye Name: 2-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]sulfanyl-N-[2-(4-methoxyphenyl)ethyl]acetamide CAS Name: 2-[[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]thio]-N-[2-(4-methoxyphenyl)ethyl]acetamide IUPAC Name: 2-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanyl-N-[2-(4-methoxyphenyl)ethyl]acetamide Traditional Name: 2-[[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]thio]-N-[2-(4-methoxyphenyl)ethyl]acetamide Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)CSCC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)CSCC(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H22N2O5S/c1-25-16-5-2-14(3-6-16)8-9-21-19(23)11-28-12-20(24)22-15-4-7-17-18(10-15)27-13-26-17/h2-7,10H,8-9,11-13H2,1H3,(H,21,23)(H,22,24)