N-(1,3-benzodioxol-5-yl)-3-[[2-(4-ethoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-[[2-(4-ethoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-[[2-(4-ethoxyphenyl)thiazol-4-yl]methylsulfanyl]propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-[[2-(4-ethoxyphenyl)-4-thiazolyl]methylthio]propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-[[2-(4-ethoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]propanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-[(2-p-phenetylthiazol-4-yl)methylthio]propionamide Formula: C22H22N2O4S2 MolecularWeight: 442.55108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=CS2)CSCCC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=CS2)CSCCC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H22N2O4S2/c1-2-26-18-6-3-15(4-7-18)22-24-17(13-30-22)12-29-10-9-21(25)23-16-5-8-19-20(11-16)28-14-27-19/h3-8,11,13H,2,9-10,12,14H2,1H3,(H,23,25)